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

C15H16N2O3 — CID 103762844

IUPACN-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCOCc1ccccc1CNC(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C15H16N2O3/c1-20-10-13-5-3-2-4-12(13)9-17-15(19)11-6-7-16-14(18)8-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyCUDVMELQLSWOQL-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.45
Rot. Bonds5

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

N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide (PubChem CID 103762844) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide
PubChem CID103762844
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide
SMILESCOCc1ccccc1CNC(=O)c1cc[nH]c(=O)c1
InChIInChI=1S/C15H16N2O3/c1-20-10-13-5-3-2-4-12(13)9-17-15(19)11-6-7-16-14(18)8-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyCUDVMELQLSWOQL-UHFFFAOYSA-N
XLogP1.45
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 110600760
3-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602369
3-fluoro-N-[[2-(methoxymethyl)phenyl]methyl]-4-methylbenzamide
CID 32604559
4-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602161
N-[(2,4-dimethoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762837
2-bromo-N-[[2-(methoxymethyl)phenyl]methyl]pyridine-4-carboxamide
CID 103752307
N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide
CID 34684530
4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 60924658
N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762651
5-bromo-N-[[2-(methoxymethyl)phenyl]methyl]pyridine-3-carboxamide
CID 32602395
3-bromo-5-chloro-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 103826531
4-hydroxy-N-[[2-(methoxymethyl)phenyl]methyl]-3-nitrobenzamide
CID 99717489

Frequently Asked Questions

What is the IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide (CID 103762844) is N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide is COCc1ccccc1CNC(=O)c1cc[nH]c(=O)c1.
What is the InChIKey of N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide?
The InChIKey is CUDVMELQLSWOQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-20-10-13-5-3-2-4-12(13)9-17-15(19)11-6-7-16-14(18)8-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide?
N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103762844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).