N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide

C15H16N2O2 — CID 103762664

IUPACN-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2cc[nH]c(=O)c2)cc1
InChIInChI=1S/C15H16N2O2/c1-11-3-5-12(6-4-11)10-17(2)15(19)13-7-8-16-14(18)9-13/h3-9H,10H2,1-2H3,(H,16,18)
InChIKeyGALNMDPZFQGATD-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.96
Rot. Bonds3

About N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide

N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103762664) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103762664
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2cc[nH]c(=O)c2)cc1
InChIInChI=1S/C15H16N2O2/c1-11-3-5-12(6-4-11)10-17(2)15(19)13-7-8-16-14(18)9-13/h3-9H,10H2,1-2H3,(H,16,18)
InChIKeyGALNMDPZFQGATD-UHFFFAOYSA-N
XLogP1.96
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-oxo-N-(pyridin-4-ylmethyl)-1H-pyridine-4-carboxamide
CID 113257132
N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763358
3-iodo-N-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 60631085
N-methyl-N-[2-(methylamino)ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103885153
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2-oxo-1H-pyridine-4-carboxamide
CID 103763351
N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18103130
N-[(4-fluorophenyl)methyl]-N,3,5-trimethylbenzamide
CID 78771211
2-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 114325571
N-[2-(4-methylphenyl)ethyl]-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyridine-4-carboxamide
CID 97070355
N-methyl-2-oxo-N-pentan-3-yl-1H-pyridine-4-carboxamide
CID 103763778
5-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 63865818
N-methyl-2-(methylamino)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 62170882

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide (CID 103762664) is N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide is Cc1ccc(CN(C)C(=O)c2cc[nH]c(=O)c2)cc1.
What is the InChIKey of N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is GALNMDPZFQGATD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-3-5-12(6-4-11)10-17(2)15(19)13-7-8-16-14(18)9-13/h3-9H,10H2,1-2H3,(H,16,18).
What are the key properties of N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103762664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).