Methyl (4-Methyl-3-pyridyl)carbamate - CAS 694495-63-1

Name: Methyl (4-Methyl-3-pyridyl)carbamate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB033829
Product Name:	Methyl (4-Methyl-3-pyridyl)carbamate
CAS:	694495-63-1
Synonyms:	N-(4-methyl-3-pyridinyl)carbamic acid methyl ester; methyl N-(4-methylpyridin-3-yl)carbamate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl N-(4-methylpyridin-3-yl)carbamate
Description:	Methyl 4-Methylpyridin-3-ylcarbamate can be used as JAK3 inhibitors for its immunosuppressant properties.
Molecular Weight:	166.18
Molecular Formula:	C8H10N2O2
Canonical SMILES:	CC1=C(C=NC=C1)NC(=O)OC
InChI:	InChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11)
InChI Key:	FTEFYIXMXZZAGN-UHFFFAOYSA-N
Boiling Point:	227.812 °C at 760 mmHg
Density:	1.201 g/cm³
MDL:	MFCD09030045
LogP:	1.64130

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[17746-05-3]C11H21ClO
Undecanoyl chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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Publication Number	Title	Priority Date
CN-112876410-A	Preparation method of N- (4-methylpyridine-3-yl) methyl carbamate	20210203
CN-112898195-A	Synthesis method of tofacitinib intermediate	20191204
EP-3421455-A1	Improved process for the preparation of chiral 3-amino-piperidins, useful intermediates for the preparation of tofacitinib	20170629
US-2019002407-A1	Process for the preparation of chiral 3-amino-piperidins, useful intermediates for the preparation of tofacitinib	20170629
CN-104860872-A	Bis-(3R,4R)-1-benzyl-N,4-dimethyl piperidin-3-amine L-di-p-toluyl tartrate synthesis method	20150327

Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.074227566
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	166.074227566
Rotatable Bond Count:	2
Topological Polar Surface Area:	51.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8