N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide

C14H14N2O3 — CID 103762651

IUPACN-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc[nH]c(=O)c2)c1
InChIInChI=1S/C14H14N2O3/c1-19-12-4-2-3-10(7-12)9-16-14(18)11-5-6-15-13(17)8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyDWBPFRHGBWQDEV-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.31
Rot. Bonds4

About N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide

N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103762651) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103762651
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc[nH]c(=O)c2)c1
InChIInChI=1S/C14H14N2O3/c1-19-12-4-2-3-10(7-12)9-16-14(18)11-5-6-15-13(17)8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyDWBPFRHGBWQDEV-UHFFFAOYSA-N
XLogP1.31
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-[(3-methoxyphenyl)methyl]-1-N-[(4-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 10272573
4-[(3-methoxyphenyl)methylcarbamoyl]benzoic acid
CID 61028664
N-[(2,4-dimethoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762837
3,4-difluoro-N-[(3-methoxyphenyl)methyl]benzamide
CID 30491738
1-N-[(3-aminophenyl)methyl]-3-N-[(3-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 10293708
N-[(3-methoxyphenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 35676429
N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
3,5-diamino-N-[(3-methoxyphenyl)methyl]benzamide
CID 61102924
3-fluoro-N-[(3-methoxyphenyl)methyl]-4-methylbenzamide
CID 9088186
3-amino-N-[(3-methoxyphenyl)methyl]-4-methylbenzamide
CID 60873375
4-formyl-N-[(3-methoxyphenyl)methyl]benzamide
CID 155923762
N-[(6-methoxy-2-pyridinyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 138041888

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide (CID 103762651) is N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide is COc1cccc(CNC(=O)c2cc[nH]c(=O)c2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is DWBPFRHGBWQDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-19-12-4-2-3-10(7-12)9-16-14(18)11-5-6-15-13(17)8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide?
N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103762651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).