2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide

C12H15F2NO3S — CID 95984043

IUPAC2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
SMILESO=S(=O)(N[C@@H]1CCC[C@@H](O)C1)c1c(F)cccc1F
InChIInChI=1S/C12H15F2NO3S/c13-10-5-2-6-11(14)12(10)19(17,18)15-8-3-1-4-9(16)7-8/h2,5-6,8-9,15-16H,1,3-4,7H2/t8-,9-/m1/s1
InChIKeyJCKOYPOHSAVSME-RKDXNWHRSA-N
MW291.32 g/mol
LogP1.55
Rot. Bonds3

About 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide

2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide (PubChem CID 95984043) has the molecular formula C12H15F2NO3S and a molecular weight of 291.32 g/mol. Its IUPAC name is 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide.

Molecular Properties

Compound Name2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
PubChem CID95984043
Molecular FormulaC12H15F2NO3S
Molecular Weight291.32 g/mol
Exact Mass291.07
IUPAC Name2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
SMILESO=S(=O)(N[C@@H]1CCC[C@@H](O)C1)c1c(F)cccc1F
InChIInChI=1S/C12H15F2NO3S/c13-10-5-2-6-11(14)12(10)19(17,18)15-8-3-1-4-9(16)7-8/h2,5-6,8-9,15-16H,1,3-4,7H2/t8-,9-/m1/s1
InChIKeyJCKOYPOHSAVSME-RKDXNWHRSA-N
XLogP1.55
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.32
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide 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

2,6-difluoro-N-[(1S,3S)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984042
3-[(2,6-difluorophenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 66030948
2,6-difluoro-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114545218
3-chloro-4-fluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984027
4-[(2,6-difluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 60809042
N-(4-aminocyclohexyl)-2,6-difluorobenzenesulfonamide;hydrochloride
CID 119970454
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-2,6-difluorobenzenesulfonamide
CID 11928435
5-chloro-N-[(1S,3S)-3-hydroxycyclohexyl]-2-methylbenzenesulfonamide
CID 95984034
4-acetyl-N-(3-hydroxycyclohexyl)benzenesulfonamide
CID 61068578
5-chloro-N-[(1S,3R)-3-hydroxycyclohexyl]thiophene-2-sulfonamide
CID 95984008
1-hydroxy-3-(sulfamoylamino)cyclohexane
CID 112686057
N-[(1S,3R)-3-hydroxycyclohexyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 95984012

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide?
The IUPAC name of 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide (CID 95984043) is 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide.
What is the SMILES notation for 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide?
The canonical SMILES for 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide is O=S(=O)(N[C@@H]1CCC[C@@H](O)C1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide?
The InChIKey is JCKOYPOHSAVSME-RKDXNWHRSA-N. The full InChI is InChI=1S/C12H15F2NO3S/c13-10-5-2-6-11(14)12(10)19(17,18)15-8-3-1-4-9(16)7-8/h2,5-6,8-9,15-16H,1,3-4,7H2/t8-,9-/m1/s1.
What are the key properties of 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide?
2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide has a molecular weight of 291.32 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide is sourced from PubChem (CID 95984043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).