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2-(2,2-Dimethyl-propionylamino)-n-methoxy-n-methyl-isonicotinamide

2-(2,2-Dimethyl-propionylamino)-n-methoxy-n-methyl-isonicotinamide - CAS 946681-81-8

Catalog:	BB062982
Product Name:	2-(2,2-Dimethyl-propionylamino)-n-methoxy-n-methyl-isonicotinamide
CAS:	946681-81-8
Synonyms:	2-(2,2-Dimethyl-propionylamino)-N-methoxy-N-methyl-isonicotinamide; 2-(2,2-dimethylpropanoylamino)-N-methoxy-N-methylpyridine-4-carboxamide

Technical Data

Computed Properties

IUPAC Name:	2-(2,2-dimethylpropanoylamino)-N-methoxy-N-methylpyridine-4-carboxamide
Description:	2-(2,2-Dimethyl-propionylamino)-n-methoxy-n-methyl-isonicotinamide
Molecular Weight:	265.31
Molecular Formula:	C13H19N3O3
Canonical SMILES:	CC(C)(C)C(=O)NC1=NC=CC(=C1)C(=O)N(C)OC
InChI:	InChI=1S/C13H19N3O3/c1-13(2,3)12(18)15-10-8-9(6-7-14-10)11(17)16(4)19-5/h6-8H,1-5H3,(H,14,15,18)
InChI Key:	ZECTXKVADDIPOY-UHFFFAOYSA-N

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Complexity:	339
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	265.14264148
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	265.14264148
Rotatable Bond Count:	4
Topological Polar Surface Area:	71.5Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3