N-(2-Methoxy-4-methyl-3-pyridyl)acetamide - CAS 76005-98-6

Catalog:	BB035464
Product Name:	N-(2-Methoxy-4-methyl-3-pyridyl)acetamide
CAS:	76005-98-6
Synonyms:	N-(2-methoxy-4-methyl-3-pyridinyl)acetamide; N-(2-methoxy-4-methylpyridin-3-yl)acetamide

Technical Data

Patents

Computed Properties

IUPAC Name:	N-(2-methoxy-4-methylpyridin-3-yl)acetamide
Description:	N-(2-Methoxy-4-methyl-3-pyridyl)acetamide (CAS# 76005-98-6 ) is a useful research chemical.
Molecular Weight:	180.20
Molecular Formula:	C9H12N2O2
Canonical SMILES:	CC1=C(C(=NC=C1)OC)NC(=O)C
InChI:	InChI=1S/C9H12N2O2/c1-6-4-5-10-9(13-3)8(6)11-7(2)12/h4-5H,1-3H3,(H,11,12)
InChI Key:	PNSGXOZEWPGLGX-UHFFFAOYSA-N
LogP:	1.43000

Publication Number	Title	Priority Date
AU-2007286345-A1	Non-nucleoside reverse transcriptase inhibitors	20060816
AU-2007286345-B2	Non-nucleoside reverse transcriptase inhibitors	20060816
CA-2658984-A1	Non-nucleoside reverse transcriptase inhibitors	20060816
CA-2658984-C	Non-nucleoside reverse transcriptase inhibitors	20060816
EP-2057125-A1	Non-nucleoside reverse transcriptase inhibitors	20060816

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Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.08987763
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	180.08987763
Rotatable Bond Count:	2
Topological Polar Surface Area:	51.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7