3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide

C19H26N4O — CID 654207

IUPAC3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCCC(c2nc3ccccc3[nH]2)C1
InChIInChI=1S/C19H26N4O/c24-19(20-15-8-2-1-3-9-15)23-12-6-7-14(13-23)18-21-16-10-4-5-11-17(16)22-18/h4-5,10-11,14-15H,1-3,6-9,12-13H2,(H,20,24)(H,21,22)
InChIKeyYPNNWFPEZQTZKV-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.78
Rot. Bonds2

About 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide

3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide (PubChem CID 654207) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide
PubChem CID654207
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCCC(c2nc3ccccc3[nH]2)C1
InChIInChI=1S/C19H26N4O/c24-19(20-15-8-2-1-3-9-15)23-12-6-7-14(13-23)18-21-16-10-4-5-11-17(16)22-18/h4-5,10-11,14-15H,1-3,6-9,12-13H2,(H,20,24)(H,21,22)
InChIKeyYPNNWFPEZQTZKV-UHFFFAOYSA-N
XLogP3.78
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide?
The IUPAC name of 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide (CID 654207) is 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide is O=C(NC1CCCCC1)N1CCCC(c2nc3ccccc3[nH]2)C1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide?
The InChIKey is YPNNWFPEZQTZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c24-19(20-15-8-2-1-3-9-15)23-12-6-7-14(13-23)18-21-16-10-4-5-11-17(16)22-18/h4-5,10-11,14-15H,1-3,6-9,12-13H2,(H,20,24)(H,21,22).
What are the key properties of 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide?
3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 3.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)-N-cyclohexylpiperidine-1-carboxamide is sourced from PubChem (CID 654207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).