N-Methoxy-N-methylcyclohexanecarboxamide - CAS 80783-98-8

Name: N-Methoxy-N-methylcyclohexanecarboxamide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB036549
Product Name:	N-Methoxy-N-methylcyclohexanecarboxamide
CAS:	80783-98-8
Synonyms:	N-methoxy-N-methylcyclohexanecarboxamide; N-methoxy-N-methylcyclohexanecarboxamide

Technical Data

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Computed Properties

IUPAC Name:	N-methoxy-N-methylcyclohexanecarboxamide
Description:	N-Methoxy-N-methylcyclohexanecarboxamide (CAS# 80783-98-8) is a useful research chemical.
Molecular Weight:	171.24
Molecular Formula:	C9H17NO2
Canonical SMILES:	CN(C(=O)C1CCCCC1)OC
InChI:	InChI=1S/C9H17NO2/c1-10(12-2)9(11)8-6-4-3-5-7-8/h8H,3-7H2,1-2H3
InChI Key:	MVBZPHKLBBUMNK-UHFFFAOYSA-N
LogP:	1.58650

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]C6H2Cl2O4
Chloranilic acid
[17746-05-3]C11H21ClO
Undecanoyl chloride
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021127333-A1	Trpml modulators	20191219
WO-2021097110-A1	Therapeutic compounds and methods of use	20191113
US-2017136018-A1	Methods for Treating MS Using Pyrimidine and Pyridine Compounds with BTK Inhibitory Activity	20151117
US-10716788-B2	Methods for treating MS using pyrimidine and pyridine compounds with BTK inhibitory activity	20151117
US-2020316068-A1	Methods for Treating MS Using Pyrimidine and Pyridine Compounds with BTK Inhibitory Activity	20151117

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.125928785
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.125928785
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9