N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

C17H21N7O — CID 125433760

IUPACN-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESO=C(CC1(Cn2cnnn2)CCCCC1)Nc1ccc2nc[nH]c2c1
InChIInChI=1S/C17H21N7O/c25-16(21-13-4-5-14-15(8-13)19-11-18-14)9-17(6-2-1-3-7-17)10-24-12-20-22-23-24/h4-5,8,11-12H,1-3,6-7,9-10H2,(H,18,19)(H,21,25)
InChIKeyHTOZDFQKRIXKIO-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.53
Rot. Bonds5

About N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide

N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (PubChem CID 125433760) has the molecular formula C17H21N7O and a molecular weight of 339.40 g/mol. Its IUPAC name is N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
PubChem CID125433760
Molecular FormulaC17H21N7O
Molecular Weight339.40 g/mol
Exact Mass339.18
IUPAC NameN-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide
SMILESO=C(CC1(Cn2cnnn2)CCCCC1)Nc1ccc2nc[nH]c2c1
InChIInChI=1S/C17H21N7O/c25-16(21-13-4-5-14-15(8-13)19-11-18-14)9-17(6-2-1-3-7-17)10-24-12-20-22-23-24/h4-5,8,11-12H,1-3,6-7,9-10H2,(H,18,19)(H,21,25)
InChIKeyHTOZDFQKRIXKIO-UHFFFAOYSA-N
XLogP2.53
TPSA101.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide 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

Adibendan
CID 65867
N-{2-[isopropyl(methyl)amino]-1H-benzimidazol-6-yl}-3-[4-(trifluoromethyl)phenyl]propanamide
CID 10024171
N-[2-[cyclopentyl(methyl)amino]-3H-benzimidazol-5-yl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 44143495
N-[2-[(1-acetylpyrrolidin-3-yl)-methylamino]-3H-benzimidazol-5-yl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 44143498
N-[2-[methyl(propan-2-yl)amino]-3H-benzimidazol-5-yl]-3-[5-(trifluoromethyl)pyridin-2-yl]propanamide
CID 44143502
N-[2-(dimethylamino)-3H-benzimidazol-5-yl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 44143492
N-[2-[ethyl(methyl)amino]-3H-benzimidazol-5-yl]-3-[4-(trifluoromethyl)phenyl]propanamide
CID 44143493
N-[2-(1-methylpyrrol-2-yl)-3H-benzimidazol-5-yl]benzamide
CID 828659
1-[1-(2-Fluoro-phenyl)-ethyl]-1H-[1,2,3]triazole-4-carboxylic acid (1H-benzoimidazol-5-yl)-amide
CID 646002
N-[2-(pyridin-3-yl)-1H-benzimidazol-5-yl]cyclohexanecarboxamide
CID 741133
N-[2-(2-pyridinyl)-3H-benzimidazol-5-yl]cyclohexanecarboxamide
CID 1084661
N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]cyclohexanecarboxamide
CID 4004019

Frequently Asked Questions

What is the IUPAC name of N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The IUPAC name of N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide (CID 125433760) is N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide.
What is the SMILES notation for N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The canonical SMILES for N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is O=C(CC1(Cn2cnnn2)CCCCC1)Nc1ccc2nc[nH]c2c1.
What is the InChIKey of N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
The InChIKey is HTOZDFQKRIXKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N7O/c25-16(21-13-4-5-14-15(8-13)19-11-18-14)9-17(6-2-1-3-7-17)10-24-12-20-22-23-24/h4-5,8,11-12H,1-3,6-7,9-10H2,(H,18,19)(H,21,25).
What are the key properties of N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide?
N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide has a molecular weight of 339.40 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3H-benzimidazol-5-yl)-2-[1-(tetrazol-1-ylmethyl)cyclohexyl]acetamide is sourced from PubChem (CID 125433760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).