2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide

C23H26N4O2 — CID 9107555

IUPAC2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide
SMILESCCCCc1nc2ccccc2n1CC(=O)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C23H26N4O2/c1-2-3-12-21-25-19-10-6-7-11-20(19)27(21)15-22(28)26-18-9-5-4-8-17(18)23(29)24-16-13-14-16/h4-11,16H,2-3,12-15H2,1H3,(H,24,29)(H,26,28)
InChIKeyHXXBJNRHRVYHOI-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.91
Rot. Bonds8

About 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide

2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide (PubChem CID 9107555) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide
PubChem CID9107555
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide
SMILESCCCCc1nc2ccccc2n1CC(=O)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C23H26N4O2/c1-2-3-12-21-25-19-10-6-7-11-20(19)27(21)15-22(28)26-18-9-5-4-8-17(18)23(29)24-16-13-14-16/h4-11,16H,2-3,12-15H2,1H3,(H,24,29)(H,26,28)
InChIKeyHXXBJNRHRVYHOI-UHFFFAOYSA-N
XLogP3.91
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[[2-[2-(trifluoromethyl)benzimidazol-1-yl]acetyl]amino]benzamide
CID 26905640
[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl] 2-(2-ethylbenzimidazol-1-yl)acetate
CID 30263426
2-(2-butylbenzimidazol-1-yl)-N-(2-cyanophenyl)acetamide
CID 39148056
2-methyl-N-[3-[1-[2-(2-methylanilino)-2-oxoethyl]benzimidazol-2-yl]propyl]benzamide
CID 17031446
N-cyclohexyl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028657
N-[2-[1-[2-(cyclohexylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]-2-methylbenzamide
CID 17030705
N-[2-[1-[2-(2,3-dimethylanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]cyclopropanecarboxamide
CID 17030488
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279
4-chloro-N-[3-[1-[2-(cyclopropylamino)-2-oxoethyl]benzimidazol-2-yl]propyl]benzamide
CID 17031635
N-methyl-2-[[2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetyl]amino]benzamide
CID 30889361
2-[2-(3-acetamidopropyl)benzimidazol-1-yl]-N-(2,3-dimethylphenyl)acetamide
CID 17030975
2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide (CID 9107555) is 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide is CCCCc1nc2ccccc2n1CC(=O)Nc1ccccc1C(=O)NC1CC1.
What is the InChIKey of 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide?
The InChIKey is HXXBJNRHRVYHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-2-3-12-21-25-19-10-6-7-11-20(19)27(21)15-22(28)26-18-9-5-4-8-17(18)23(29)24-16-13-14-16/h4-11,16H,2-3,12-15H2,1H3,(H,24,29)(H,26,28).
What are the key properties of 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide?
2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide has a molecular weight of 390.49 g/mol, XLogP of 3.91, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-butylbenzimidazol-1-yl)acetyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 9107555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).