1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide

C11H23NO3S — CID 62334090

IUPAC1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide
SMILESCC(O)CN(C)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C11H23NO3S/c1-10(13)8-12(2)16(14,15)9-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeyBMGNYCKTPDXPCS-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.21
Rot. Bonds5

About 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide

1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide (PubChem CID 62334090) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide
PubChem CID62334090
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC Name1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide
SMILESCC(O)CN(C)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C11H23NO3S/c1-10(13)8-12(2)16(14,15)9-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeyBMGNYCKTPDXPCS-UHFFFAOYSA-N
XLogP1.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide 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 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide (CID 62334090) is 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide is CC(O)CN(C)S(=O)(=O)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide?
The InChIKey is BMGNYCKTPDXPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-10(13)8-12(2)16(14,15)9-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide?
1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide has a molecular weight of 249.38 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 62334090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).