N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

C16H15N3O3 — CID 110701179

IUPACN-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C16H15N3O3/c1-22-13-8-3-2-5-10(13)9-17-15(20)11-6-4-7-12-14(11)19-16(21)18-12/h2-8H,9H2,1H3,(H,17,20)(H2,18,19,21)
InChIKeyNPIJETMNMQRSQO-UHFFFAOYSA-N
MW297.31 g/mol
LogP1.79
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (PubChem CID 110701179) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
PubChem CID110701179
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C16H15N3O3/c1-22-13-8-3-2-5-10(13)9-17-15(20)11-6-4-7-12-14(11)19-16(21)18-12/h2-8H,9H2,1H3,(H,17,20)(H2,18,19,21)
InChIKeyNPIJETMNMQRSQO-UHFFFAOYSA-N
XLogP1.79
TPSA86.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
2-benzamido-N-[(2-methoxyphenyl)methyl]benzamide
CID 9404635
N-[(2-methoxyphenyl)methyl]-1H-indole-2-carboxamide
CID 9270219
N-[(2-methoxyphenyl)methyl]-2-methylsulfonylbenzamide
CID 18081414
3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
CID 62648542
2-(difluoromethoxy)-3-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 51143674
N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701357
N-[(2-methoxyphenyl)methyl]-3-oxo-4H-1,4-benzoxazine-5-carboxamide
CID 110699663

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (CID 110701179) is N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is COc1ccccc1CNC(=O)c1cccc2[nH]c(=O)[nH]c12.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The InChIKey is NPIJETMNMQRSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-22-13-8-3-2-5-10(13)9-17-15(20)11-6-4-7-12-14(11)19-16(21)18-12/h2-8H,9H2,1H3,(H,17,20)(H2,18,19,21).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide has a molecular weight of 297.31 g/mol, XLogP of 1.79, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is sourced from PubChem (CID 110701179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).