3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide

C16H24N2O3S — CID 24687507

IUPAC3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)CCNS(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O3S/c1-13-7-9-14(10-8-13)18-16(19)11-12-17-22(20,21)15-5-3-2-4-6-15/h2-6,13-14,17H,7-12H2,1H3,(H,18,19)
InChIKeyDFAVSQRPLTZGHU-UHFFFAOYSA-N
MW324.45 g/mol
LogP2.05
Rot. Bonds6

About 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide

3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide (PubChem CID 24687507) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide
PubChem CID24687507
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC Name3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)CCNS(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O3S/c1-13-7-9-14(10-8-13)18-16(19)11-12-17-22(20,21)15-5-3-2-4-6-15/h2-6,13-14,17H,7-12H2,1H3,(H,18,19)
InChIKeyDFAVSQRPLTZGHU-UHFFFAOYSA-N
XLogP2.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide 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-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide?
The IUPAC name of 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide (CID 24687507) is 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide is CC1CCC(NC(=O)CCNS(=O)(=O)c2ccccc2)CC1.
What is the InChIKey of 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide?
The InChIKey is DFAVSQRPLTZGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-13-7-9-14(10-8-13)18-16(19)11-12-17-22(20,21)15-5-3-2-4-6-15/h2-6,13-14,17H,7-12H2,1H3,(H,18,19).
What are the key properties of 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide?
3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide has a molecular weight of 324.45 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 24687507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).