2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide

C12H15Cl2NO3S — CID 43389462

IUPAC2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide
SMILESO=S(=O)(NC1CCC(O)CC1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H15Cl2NO3S/c13-10-2-1-3-11(14)12(10)19(17,18)15-8-4-6-9(16)7-5-8/h1-3,8-9,15-16H,4-7H2
InChIKeyMYXMBOSNFBOYHG-UHFFFAOYSA-N
MW324.23 g/mol
LogP2.58
Rot. Bonds3

About 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide

2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide (PubChem CID 43389462) has the molecular formula C12H15Cl2NO3S and a molecular weight of 324.23 g/mol. Its IUPAC name is 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide.

Molecular Properties

Compound Name2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide
PubChem CID43389462
Molecular FormulaC12H15Cl2NO3S
Molecular Weight324.23 g/mol
Exact Mass323.01
IUPAC Name2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide
SMILESO=S(=O)(NC1CCC(O)CC1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H15Cl2NO3S/c13-10-2-1-3-11(14)12(10)19(17,18)15-8-4-6-9(16)7-5-8/h1-3,8-9,15-16H,4-7H2
InChIKeyMYXMBOSNFBOYHG-UHFFFAOYSA-N
XLogP2.58
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.23
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dichloro-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960503
3-[(2,6-dichlorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 63042404
4-bromo-3-chloro-N-(4-hydroxycyclohexyl)benzenesulfonamide
CID 134367233
4-amino-2,6-dichloro-N-cyclopropylbenzenesulfonamide
CID 43256975
2,6-dichloro-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzenesulfonamide
CID 114631595
4-[(6-chloro-2,3-difluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 122071127
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)-2,6-dichlorobenzenesulfonamide
CID 66197296
N-[(1R,2R)-2-aminocyclohexyl]-2,6-dichlorobenzenesulfonamide
CID 93453493
5-bromo-2-chlorobenzenesulfonyl chloride;5-bromo-2-chloro-N-(4-hydroxycyclohexyl)benzenesulfonamide
CID 87549933
2-chloro-6-nitro-N-piperidin-4-ylbenzenesulfonamide
CID 119960582
4-[(2,6-difluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 60809042
3-chloro-N-cyclopropylpyridine-2-sulfonamide
CID 71646489

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide?
The IUPAC name of 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide (CID 43389462) is 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide.
What is the SMILES notation for 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide?
The canonical SMILES for 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide is O=S(=O)(NC1CCC(O)CC1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide?
The InChIKey is MYXMBOSNFBOYHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO3S/c13-10-2-1-3-11(14)12(10)19(17,18)15-8-4-6-9(16)7-5-8/h1-3,8-9,15-16H,4-7H2.
What are the key properties of 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide?
2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide has a molecular weight of 324.23 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(4-hydroxycyclohexyl)benzenesulfonamide is sourced from PubChem (CID 43389462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).