N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide

C21H20N2O2 — CID 7598420

IUPACN-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCc1cccc(Cn2cccc(C(=O)N(C)c3ccccc3)c2=O)c1
InChIInChI=1S/C21H20N2O2/c1-16-8-6-9-17(14-16)15-23-13-7-12-19(21(23)25)20(24)22(2)18-10-4-3-5-11-18/h3-14H,15H2,1-2H3
InChIKeyGIEJRGTYELCKTR-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.48
Rot. Bonds4

About N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide

N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide (PubChem CID 7598420) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide
PubChem CID7598420
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC NameN-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCc1cccc(Cn2cccc(C(=O)N(C)c3ccccc3)c2=O)c1
InChIInChI=1S/C21H20N2O2/c1-16-8-6-9-17(14-16)15-23-13-7-12-19(21(23)25)20(24)22(2)18-10-4-3-5-11-18/h3-14H,15H2,1-2H3
InChIKeyGIEJRGTYELCKTR-UHFFFAOYSA-N
XLogP3.48
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-N-methyl-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110907214
N-[(2S)-3,3-dimethylbutan-2-yl]-N-methyl-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 52539461
N-ethyl-N-(3-methylphenyl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598795
1-benzyl-4-[(3-methylphenyl)methyl]pyrazine-2,3-dione
CID 22520187
N-(3-hydroxypropyl)-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110907215
N-(2-hydroxyethyl)-N-[(1S,2R)-2-methylcyclopentyl]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 124882650
N-[(1-hydroxycyclobutyl)methyl]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 111445693
3-fluoro-1-[(3-methylphenyl)methyl]pyridin-2-one
CID 174323463
1-[(3-methylphenyl)methyl]-2-oxo-N-(5-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 86845826
3-methyl-1-[1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 119256185
(3R)-4-[1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]morpholine-3-carboxylic acid
CID 125151027
4-[1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]morpholine-2-carboxylic acid
CID 126786953

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide?
The IUPAC name of N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide (CID 7598420) is N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide?
The canonical SMILES for N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide is Cc1cccc(Cn2cccc(C(=O)N(C)c3ccccc3)c2=O)c1.
What is the InChIKey of N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide?
The InChIKey is GIEJRGTYELCKTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-16-8-6-9-17(14-16)15-23-13-7-12-19(21(23)25)20(24)22(2)18-10-4-3-5-11-18/h3-14H,15H2,1-2H3.
What are the key properties of N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide?
N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide has a molecular weight of 332.40 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(3-methylphenyl)methyl]-2-oxo-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 7598420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).