4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide

C18H21NO3S — CID 18515473

IUPAC4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(O)c1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H21NO3S/c20-17-8-4-7-16(13-17)19-23(21,22)18-11-9-15(10-12-18)14-5-2-1-3-6-14/h4,7-14,19-20H,1-3,5-6H2
InChIKeyPXMNCWCHMQRVEP-UHFFFAOYSA-N
MW331.44 g/mol
LogP4.24
Rot. Bonds4

About 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide

4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide (PubChem CID 18515473) has the molecular formula C18H21NO3S and a molecular weight of 331.44 g/mol. Its IUPAC name is 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide
PubChem CID18515473
Molecular FormulaC18H21NO3S
Molecular Weight331.44 g/mol
Exact Mass331.12
IUPAC Name4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc(O)c1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H21NO3S/c20-17-8-4-7-16(13-17)19-23(21,22)18-11-9-15(10-12-18)14-5-2-1-3-6-14/h4,7-14,19-20H,1-3,5-6H2
InChIKeyPXMNCWCHMQRVEP-UHFFFAOYSA-N
XLogP4.24
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxyphenyl)-4-iodobenzenesulfonamide
CID 4254070
4-[(3-hydroxyphenyl)sulfamoyl]benzoic acid
CID 25035947
2-N,7-N-bis(3-hydroxyphenyl)-9-oxofluorene-2,7-disulfonamide
CID 10075434
N-cyclopropyl-3-[(4-cyclopropylphenyl)sulfonylamino]benzamide
CID 167833629
N-[3-[(4-cyclohexylphenyl)sulfonylamino]phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 52689645
4-(2-aminophenyl)-N-(3-hydroxyphenyl)benzenesulfonamide
CID 110454372
5-[(4-cyclohexylphenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
CID 8519759
2-[4-[(3-hydroxyphenyl)sulfamoyl]phenyl]acetic acid
CID 61167886
3-cyclohexylphenol
CID 16036
1-[3-[(4-cyclohexylphenyl)sulfonylamino]benzoyl]-N-propan-2-ylpyrrolidine-2-carboxamide
CID 50815951
4-cyclohexyl-N-[4-[(R)-methylsulfinyl]phenyl]benzenesulfonamide
CID 95781125
4-cyclohexyl-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43532736

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide?
The IUPAC name of 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide (CID 18515473) is 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide is O=S(=O)(Nc1cccc(O)c1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide?
The InChIKey is PXMNCWCHMQRVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3S/c20-17-8-4-7-16(13-17)19-23(21,22)18-11-9-15(10-12-18)14-5-2-1-3-6-14/h4,7-14,19-20H,1-3,5-6H2.
What are the key properties of 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide?
4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide has a molecular weight of 331.44 g/mol, XLogP of 4.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(3-hydroxyphenyl)benzenesulfonamide is sourced from PubChem (CID 18515473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).