3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide

C13H26N2O2S — CID 42894521

IUPAC3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
SMILESCC1CCC(NS(=O)(=O)N2CCCC(C)C2)CC1
InChIInChI=1S/C13H26N2O2S/c1-11-5-7-13(8-6-11)14-18(16,17)15-9-3-4-12(2)10-15/h11-14H,3-10H2,1-2H3
InChIKeyUHPFVODAHYCHJZ-UHFFFAOYSA-N
MW274.43 g/mol
LogP2.13
Rot. Bonds3

About 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide

3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide (PubChem CID 42894521) has the molecular formula C13H26N2O2S and a molecular weight of 274.43 g/mol. Its IUPAC name is 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
PubChem CID42894521
Molecular FormulaC13H26N2O2S
Molecular Weight274.43 g/mol
Exact Mass274.17
IUPAC Name3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
SMILESCC1CCC(NS(=O)(=O)N2CCCC(C)C2)CC1
InChIInChI=1S/C13H26N2O2S/c1-11-5-7-13(8-6-11)14-18(16,17)15-9-3-4-12(2)10-15/h11-14H,3-10H2,1-2H3
InChIKeyUHPFVODAHYCHJZ-UHFFFAOYSA-N
XLogP2.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(4-methylcyclohexyl)piperidine-1-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 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide?
The IUPAC name of 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide (CID 42894521) is 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide.
What is the SMILES notation for 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide?
The canonical SMILES for 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide is CC1CCC(NS(=O)(=O)N2CCCC(C)C2)CC1.
What is the InChIKey of 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide?
The InChIKey is UHPFVODAHYCHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2S/c1-11-5-7-13(8-6-11)14-18(16,17)15-9-3-4-12(2)10-15/h11-14H,3-10H2,1-2H3.
What are the key properties of 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide?
3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide has a molecular weight of 274.43 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide is sourced from PubChem (CID 42894521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).