2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide

C16H22N4O — CID 25190747

IUPAC2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide
SMILESCCCN1CCCCC1c1nc2c(C(N)=O)cccc2[nH]1
InChIInChI=1S/C16H22N4O/c1-2-9-20-10-4-3-8-13(20)16-18-12-7-5-6-11(15(17)21)14(12)19-16/h5-7,13H,2-4,8-10H2,1H3,(H2,17,21)(H,18,19)
InChIKeyZAYFJAYEEOETOQ-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.60
Rot. Bonds4

About 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide

2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide (PubChem CID 25190747) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide.

Molecular Properties

Compound Name2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide
PubChem CID25190747
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide
SMILESCCCN1CCCCC1c1nc2c(C(N)=O)cccc2[nH]1
InChIInChI=1S/C16H22N4O/c1-2-9-20-10-4-3-8-13(20)16-18-12-7-5-6-11(15(17)21)14(12)19-16/h5-7,13H,2-4,8-10H2,1H3,(H2,17,21)(H,18,19)
InChIKeyZAYFJAYEEOETOQ-UHFFFAOYSA-N
XLogP2.60
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide 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-(4-ethyl-4-azaspiro[2.4]heptan-5-yl)-1H-benzimidazole-4-carboxamide
CID 25229883
2-[(3S)-1-methylpyrrolidin-3-yl]-1H-benzimidazole-4-carboxamide
CID 51137868
2-(2-methyl-1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide
CID 11960920
2-(1-acetylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide
CID 18428045
2-[(3S)-1-acetylpyrrolidin-3-yl]-1H-benzimidazole-4-carboxamide
CID 51137901
2-(1-acetylpiperidin-3-yl)-1H-benzimidazole-4-carboxamide
CID 18428036
2-(1-propan-2-ylpiperidin-4-yl)-1H-benzimidazole-4-carboxamide
CID 18428049
2-[4-[2-(2-methylpyrrolidin-1-yl)ethyl]phenyl]-1H-benzimidazole-4-carboxamide
CID 24825799
2-(4-methoxycyclohexyl)-1H-benzimidazole-4-carboxamide
CID 10221158
2-(1-ethylpiperidin-2-yl)-1H-imidazo[4,5-b]pyridine
CID 117163031
2-(azepan-4-yl)-1H-benzimidazole-4-carboxamide
CID 25190722
2-(3-methyl-1-propylazetidin-3-yl)-1H-benzimidazole-4-carboxamide
CID 11960832

Frequently Asked Questions

What is the IUPAC name of 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide?
The IUPAC name of 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide (CID 25190747) is 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide.
What is the SMILES notation for 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide?
The canonical SMILES for 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide is CCCN1CCCCC1c1nc2c(C(N)=O)cccc2[nH]1.
What is the InChIKey of 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide?
The InChIKey is ZAYFJAYEEOETOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-2-9-20-10-4-3-8-13(20)16-18-12-7-5-6-11(15(17)21)14(12)19-16/h5-7,13H,2-4,8-10H2,1H3,(H2,17,21)(H,18,19).
What are the key properties of 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide?
2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide has a molecular weight of 286.38 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propylpiperidin-2-yl)-1H-benzimidazole-4-carboxamide is sourced from PubChem (CID 25190747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).