N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide

C11H19N3O2S — CID 64724992

IUPACN-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide
SMILESCC1CC(C)CC(NS(=O)(=O)c2cnc[nH]2)C1
InChIInChI=1S/C11H19N3O2S/c1-8-3-9(2)5-10(4-8)14-17(15,16)11-6-12-7-13-11/h6-10,14H,3-5H2,1-2H3,(H,12,13)
InChIKeyPXVCSIKVAJKPSM-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.51
Rot. Bonds3

About N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide

N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide (PubChem CID 64724992) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide
PubChem CID64724992
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide
SMILESCC1CC(C)CC(NS(=O)(=O)c2cnc[nH]2)C1
InChIInChI=1S/C11H19N3O2S/c1-8-3-9(2)5-10(4-8)14-17(15,16)11-6-12-7-13-11/h6-10,14H,3-5H2,1-2H3,(H,12,13)
InChIKeyPXVCSIKVAJKPSM-UHFFFAOYSA-N
XLogP1.51
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide (CID 64724992) is N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide is CC1CC(C)CC(NS(=O)(=O)c2cnc[nH]2)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide?
The InChIKey is PXVCSIKVAJKPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-8-3-9(2)5-10(4-8)14-17(15,16)11-6-12-7-13-11/h6-10,14H,3-5H2,1-2H3,(H,12,13).
What are the key properties of N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide?
N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 64724992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).