N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide

C17H19N3O3 — CID 131900046

IUPACN-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2C)cn1
InChIInChI=1S/C17H19N3O3/c1-11-13(17(22)20(2)3)6-5-7-14(11)19-16(21)12-8-9-15(23-4)18-10-12/h5-10H,1-4H3,(H,19,21)
InChIKeyDASXFCWUTUETQF-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.35
Rot. Bonds4

About N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide

N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide (PubChem CID 131900046) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide
PubChem CID131900046
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2C)cn1
InChIInChI=1S/C17H19N3O3/c1-11-13(17(22)20(2)3)6-5-7-14(11)19-16(21)12-8-9-15(23-4)18-10-12/h5-10H,1-4H3,(H,19,21)
InChIKeyDASXFCWUTUETQF-UHFFFAOYSA-N
XLogP2.35
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylcarbamoyl)-4,5-dimethoxyphenyl]-6-methoxypyridine-3-carboxamide
CID 32514301
6-methoxy-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 84580545
6-methoxy-N-phenylpyridine-3-carboxamide
CID 44512975
6-methoxy-N-[2-(2-phenylethylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 33253802
N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
CID 131923245
N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 34657042
3-bromo-2-[(6-methoxypyridine-3-carbonyl)amino]benzoic acid
CID 63112885
6-methoxy-N-[2-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 35204389
N-[3-(dimethylcarbamoyl)-2-methylphenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 131897206
6-methoxy-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 84581357
N-[3-(hydroxymethyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 60698682
N-[2-(2-ethylanilino)-2-oxoethyl]-6-methoxypyridine-3-carboxamide
CID 24531875

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide (CID 131900046) is N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)Nc2cccc(C(=O)N(C)C)c2C)cn1.
What is the InChIKey of N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is DASXFCWUTUETQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-11-13(17(22)20(2)3)6-5-7-14(11)19-16(21)12-8-9-15(23-4)18-10-12/h5-10H,1-4H3,(H,19,21).
What are the key properties of N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide?
N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 131900046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).