N,N-Dimethylpiperidine-3-carboxamide - CAS 5505-20-4

Catalog:	BB028901
Product Name:	N,N-Dimethylpiperidine-3-carboxamide
CAS:	5505-20-4
Synonyms:	N,N-dimethyl-3-piperidinecarboxamide; N,N-dimethylpiperidine-3-carboxamide

Technical Data

Patents

Computed Properties

IUPAC Name:	N,N-dimethylpiperidine-3-carboxamide
Description:	N,N-Dimethylpiperidine-3-carboxamide (CAS# 5505-20-4) is used as a reactant in the preparation of highly potent small molecule hepatitis C Virus entry inhibitors.
Molecular Weight:	156.23
Molecular Formula:	C8H16N2O
Canonical SMILES:	CN(C)C(=O)C1CCCNC1
InChI:	InChI=1S/C8H16N2O/c1-10(2)8(11)7-4-3-5-9-6-7/h7,9H,3-6H2,1-2H3
InChI Key:	KLSDFCJMDZZDKK-UHFFFAOYSA-N
LogP:	0.40300

Publication Number	Title	Priority Date
WO-2019143719-A1	Inhibitors of cyclin-dependent kinase 7 (cdk7)	20180116
EP-3740207-A1	Inhibitors of cyclin-dependent kinase 7 (cdk7)	20180116
AU-2018351059-A1	Benzimidazole derivatives and their uses	20171019
US-2020308145-A1	Benzimidazole derivatives and their uses	20171019
CN-109563085-A	Piperidines CXCR7 receptor modulators	20160728

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Related Functional Groups

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Complexity:	145
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	156.126263138
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	156.126263138
Rotatable Bond Count:	1
Topological Polar Surface Area:	32.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.7