4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide

C26H24N4O2 — CID 55950490

IUPAC4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C26H24N4O2/c31-25(28-21-8-6-7-20(17-21)26(32)29-15-4-1-5-16-29)19-11-13-22(14-12-19)30-18-27-23-9-2-3-10-24(23)30/h2-3,6-14,17-18H,1,4-5,15-16H2,(H,28,31)
InChIKeyYSMWZLRFVZAFLI-UHFFFAOYSA-N
MW424.50 g/mol
LogP4.90
Rot. Bonds4

About 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide

4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide (PubChem CID 55950490) has the molecular formula C26H24N4O2 and a molecular weight of 424.50 g/mol. Its IUPAC name is 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide
PubChem CID55950490
Molecular FormulaC26H24N4O2
Molecular Weight424.50 g/mol
Exact Mass424.19
IUPAC Name4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C26H24N4O2/c31-25(28-21-8-6-7-20(17-21)26(32)29-15-4-1-5-16-29)19-11-13-22(14-12-19)30-18-27-23-9-2-3-10-24(23)30/h2-3,6-14,17-18H,1,4-5,15-16H2,(H,28,31)
InChIKeyYSMWZLRFVZAFLI-UHFFFAOYSA-N
XLogP4.90
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[4-(benzimidazol-1-yl)benzoyl]piperazin-1-yl]-phenylmethanone
CID 17475824
methyl N-[3-[[4-(benzimidazol-1-yl)benzoyl]amino]phenyl]carbamate
CID 87037290
N-[3-(pyrrolidine-1-carbonyl)phenyl]pyridine-4-carboxamide
CID 25049788
N-(3-acetylphenyl)-3-(azepane-1-carbonyl)benzamide
CID 109056722
[4-(benzimidazol-1-yl)phenyl]-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methanone
CID 22109870
[1-(4-tert-butylphenyl)benzimidazol-5-yl]-piperidin-1-ylmethanone
CID 71307830
4-[6-(azetidine-1-carbonyl)benzimidazol-1-yl]-N-methylsulfonylbenzamide
CID 137490400
4-(benzimidazol-1-yl)-N-[3-(dimethylsulfamoyl)phenyl]benzamide
CID 17426076
4-(benzimidazol-1-yl)-N-[3-(sulfamoylmethyl)phenyl]benzamide
CID 60610861
N-[3-(azepane-1-carbonyl)phenyl]-4-nitrobenzamide
CID 26159233
4-(benzimidazol-1-yl)-N-(3,4-dimethoxyphenyl)benzamide
CID 17434692
4-(benzimidazol-1-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CID 78804591

Frequently Asked Questions

What is the IUPAC name of 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide?
The IUPAC name of 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide (CID 55950490) is 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide is O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccc(-n2cnc3ccccc32)cc1.
What is the InChIKey of 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide?
The InChIKey is YSMWZLRFVZAFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O2/c31-25(28-21-8-6-7-20(17-21)26(32)29-15-4-1-5-16-29)19-11-13-22(14-12-19)30-18-27-23-9-2-3-10-24(23)30/h2-3,6-14,17-18H,1,4-5,15-16H2,(H,28,31).
What are the key properties of 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide?
4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide has a molecular weight of 424.50 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzimidazol-1-yl)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 55950490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).