N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide

C12H25NO3S — CID 116817251

IUPACN-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(C)C1CCC(CCO)CC1
InChIInChI=1S/C12H25NO3S/c1-10(2)17(15,16)13(3)12-6-4-11(5-7-12)8-9-14/h10-12,14H,4-9H2,1-3H3
InChIKeyVPTHJEULKZFVLZ-UHFFFAOYSA-N
MW263.40 g/mol
LogP1.60
Rot. Bonds5

About N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide

N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide (PubChem CID 116817251) has the molecular formula C12H25NO3S and a molecular weight of 263.40 g/mol. Its IUPAC name is N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide
PubChem CID116817251
Molecular FormulaC12H25NO3S
Molecular Weight263.40 g/mol
Exact Mass263.16
IUPAC NameN-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(C)C1CCC(CCO)CC1
InChIInChI=1S/C12H25NO3S/c1-10(2)17(15,16)13(3)12-6-4-11(5-7-12)8-9-14/h10-12,14H,4-9H2,1-3H3
InChIKeyVPTHJEULKZFVLZ-UHFFFAOYSA-N
XLogP1.60
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide 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

N-(4-hydroxycyclohexyl)-N-methylpropane-2-sulfonamide
CID 115277390
N-cycloheptyl-N-methylpropane-2-sulfonamide
CID 61383845
N-methyl-N-(4-oxocyclohexyl)propane-2-sulfonamide
CID 79120565
N-cyclobutyl-N-(2-hydroxyethyl)propane-2-sulfonamide
CID 102675881
N-methyl-N-(1-methylpiperidin-3-yl)propane-2-sulfonamide
CID 64586876
2-ethyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylbutanamide
CID 115270396
N-methyl-N-[1-(2,2,3-trimethylbutanoyl)piperidin-4-yl]propane-2-sulfonamide
CID 69472093
N-cyclopropyl-N-[4-(2-hydroxyethyl)cyclohexyl]formamide
CID 143724472
3-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropanamide
CID 116817268
2-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylacetamide
CID 116817264
N-cyclobutyl-4-(2-hydroxyethyl)-N-methylcyclohexane-1-carboxamide
CID 115151010
N-cyclopropyl-N-[(2R)-1-hydroxybutan-2-yl]propane-2-sulfonamide
CID 166767108

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide?
The IUPAC name of N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide (CID 116817251) is N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide.
What is the SMILES notation for N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide?
The canonical SMILES for N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide is CC(C)S(=O)(=O)N(C)C1CCC(CCO)CC1.
What is the InChIKey of N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide?
The InChIKey is VPTHJEULKZFVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3S/c1-10(2)17(15,16)13(3)12-6-4-11(5-7-12)8-9-14/h10-12,14H,4-9H2,1-3H3.
What are the key properties of N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide?
N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide has a molecular weight of 263.40 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropane-2-sulfonamide is sourced from PubChem (CID 116817251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).