3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide

C17H17N3O2 — CID 110785783

IUPAC3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCc2ccc3c(c2)ncn3C)c1
InChIInChI=1S/C17H17N3O2/c1-20-11-19-15-8-12(6-7-16(15)20)10-18-17(21)13-4-3-5-14(9-13)22-2/h3-9,11H,10H2,1-2H3,(H,18,21)
InChIKeyWMGSHTWNXPWIPA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.51
Rot. Bonds4

About 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide

3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide (PubChem CID 110785783) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
PubChem CID110785783
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCc2ccc3c(c2)ncn3C)c1
InChIInChI=1S/C17H17N3O2/c1-20-11-19-15-8-12(6-7-16(15)20)10-18-17(21)13-4-3-5-14(9-13)22-2/h3-9,11H,10H2,1-2H3,(H,18,21)
InChIKeyWMGSHTWNXPWIPA-UHFFFAOYSA-N
XLogP2.51
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide 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-methoxyphenyl)-N-[(1-methylbenzimidazol-5-yl)methyl]acetamide
CID 110785836
N-[2-(4-methoxyphenyl)ethyl]-1-methylbenzimidazole-5-carboxamide
CID 110692591
N-(3-methoxyphenyl)-2-(1-methylbenzimidazol-5-yl)acetamide
CID 110772965
2-chloro-N-[(1-methylbenzimidazol-5-yl)methyl]pyridine-3-carboxamide
CID 53014032
3-(7-methoxyquinolin-4-yl)oxy-2-methyl-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
CID 155779109
3-methyl-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
CID 110791606
1-cyano-N-[(1-methylbenzimidazol-5-yl)methyl]formamide
CID 115172225
N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
3-N-[(3-methoxyphenyl)methyl]-1-N-[(4-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 10272573
N-[(1-methylbenzimidazol-5-yl)methyl]-2-sulfanylacetamide
CID 115167209
3-acetamido-N-[2-(1-methylbenzimidazol-5-yl)ethyl]benzamide
CID 110796161
2,4-dimethyl-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide
CID 53014028

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide?
The IUPAC name of 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide (CID 110785783) is 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide?
The canonical SMILES for 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide is COc1cccc(C(=O)NCc2ccc3c(c2)ncn3C)c1.
What is the InChIKey of 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide?
The InChIKey is WMGSHTWNXPWIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-20-11-19-15-8-12(6-7-16(15)20)10-18-17(21)13-4-3-5-14(9-13)22-2/h3-9,11H,10H2,1-2H3,(H,18,21).
What are the key properties of 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide?
3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide has a molecular weight of 295.34 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(1-methylbenzimidazol-5-yl)methyl]benzamide is sourced from PubChem (CID 110785783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).