3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide

C18H19N3O — CID 8914480

IUPAC3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide
SMILESCCCn1c(NC(=O)c2cccc(C)c2)nc2ccccc21
InChIInChI=1S/C18H19N3O/c1-3-11-21-16-10-5-4-9-15(16)19-18(21)20-17(22)14-8-6-7-13(2)12-14/h4-10,12H,3,11H2,1-2H3,(H,19,20,22)
InChIKeyFWPFZBYAQQBDBV-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.01
Rot. Bonds4

About 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide

3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide (PubChem CID 8914480) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide
PubChem CID8914480
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide
SMILESCCCn1c(NC(=O)c2cccc(C)c2)nc2ccccc21
InChIInChI=1S/C18H19N3O/c1-3-11-21-16-10-5-4-9-15(16)19-18(21)20-17(22)14-8-6-7-13(2)12-14/h4-10,12H,3,11H2,1-2H3,(H,19,20,22)
InChIKeyFWPFZBYAQQBDBV-UHFFFAOYSA-N
XLogP4.01
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(1-propylbenzimidazol-2-yl)benzamide
CID 4800861
N-(1-octylbenzimidazol-2-yl)benzamide
CID 21449929
3-N-[5-(hydroxymethyl)-1-propylbenzimidazol-2-yl]benzene-1,3-dicarboxamide
CID 164600980
4-chloro-3-(methylsulfamoyl)-N-(1-propylbenzimidazol-2-yl)benzamide
CID 24628743
methyl 3-[2-[(3-aminobenzoyl)amino]benzimidazol-1-yl]propanoate
CID 68792716
3-[(1,1-dioxothiolan-3-yl)sulfamoyl]-N-(1-propylbenzimidazol-2-yl)benzamide
CID 24601105
4-fluoro-N-[1-[2-(3-methylphenoxy)ethyl]benzimidazol-2-yl]benzamide
CID 4044810
2,4-difluoro-N-(1-propylbenzimidazol-2-yl)benzamide
CID 40589359
3-[[1-(6-bromohexyl)benzimidazol-2-yl]carbamoyl]benzoic acid
CID 172789945
4-(diethylsulfamoyl)-N-(1-propylbenzimidazol-2-yl)benzamide
CID 7408843
3-amino-N-[1-(3-ethoxypropyl)benzimidazol-2-yl]benzamide;hydrochloride
CID 119770789
1-propyl-N-(1-propylbenzimidazol-2-yl)pyrazole-3-carboxamide
CID 35535185

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide?
The IUPAC name of 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide (CID 8914480) is 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide?
The canonical SMILES for 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide is CCCn1c(NC(=O)c2cccc(C)c2)nc2ccccc21.
What is the InChIKey of 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide?
The InChIKey is FWPFZBYAQQBDBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-3-11-21-16-10-5-4-9-15(16)19-18(21)20-17(22)14-8-6-7-13(2)12-14/h4-10,12H,3,11H2,1-2H3,(H,19,20,22).
What are the key properties of 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide?
3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide has a molecular weight of 293.37 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-propylbenzimidazol-2-yl)benzamide is sourced from PubChem (CID 8914480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).