2-cyclohexyloxy-4-methoxybenzenesulfonamide

C13H19NO4S — CID 69224689

IUPAC2-cyclohexyloxy-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)c(OC2CCCCC2)c1
InChIInChI=1S/C13H19NO4S/c1-17-11-7-8-13(19(14,15)16)12(9-11)18-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,14,15,16)
InChIKeyHFYKKOBVADQTSG-UHFFFAOYSA-N
MW285.36 g/mol
LogP2.05
Rot. Bonds4

About 2-cyclohexyloxy-4-methoxybenzenesulfonamide

2-cyclohexyloxy-4-methoxybenzenesulfonamide (PubChem CID 69224689) has the molecular formula C13H19NO4S and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-cyclohexyloxy-4-methoxybenzenesulfonamide.

Molecular Properties

Compound Name2-cyclohexyloxy-4-methoxybenzenesulfonamide
PubChem CID69224689
Molecular FormulaC13H19NO4S
Molecular Weight285.36 g/mol
Exact Mass285.10
IUPAC Name2-cyclohexyloxy-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)c(OC2CCCCC2)c1
InChIInChI=1S/C13H19NO4S/c1-17-11-7-8-13(19(14,15)16)12(9-11)18-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,14,15,16)
InChIKeyHFYKKOBVADQTSG-UHFFFAOYSA-N
XLogP2.05
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-cyclohexyloxy-4-sulfamoylphenyl)boronic acid
CID 67097987
4-cyclohexyloxy-2,3-dimethylbenzenesulfonamide
CID 43342353
2-amino-4-cyclopentyloxybenzenesulfonamide
CID 79466823
2-cyclohexyloxy-4-methoxybenzoic acid
CID 61269041
4-methoxy-2-propan-2-yloxybenzenesulfonamide
CID 69224497
N-[(2-cyclohexyloxy-4-methoxyphenyl)methyl]-2-methylpropan-2-amine
CID 63056453
2-cyclobutyloxy-4-methoxybenzenecarbothioamide
CID 81302804
2-formyl-4-methoxybenzenesulfonamide
CID 102084002
2-(4,4-dimethylcyclohexyl)oxy-4-methoxyaniline
CID 114340540
4-cyclopentyloxybenzenesulfonamide
CID 43164525
2-(hydroxymethyl)-4-methoxybenzenesulfonamide
CID 67168933
(NE)-N-[1-(2-cyclopentyloxy-4-methoxyphenyl)ethylidene]hydroxylamine
CID 82001227

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-4-methoxybenzenesulfonamide?
The IUPAC name of 2-cyclohexyloxy-4-methoxybenzenesulfonamide (CID 69224689) is 2-cyclohexyloxy-4-methoxybenzenesulfonamide.
What is the SMILES notation for 2-cyclohexyloxy-4-methoxybenzenesulfonamide?
The canonical SMILES for 2-cyclohexyloxy-4-methoxybenzenesulfonamide is COc1ccc(S(N)(=O)=O)c(OC2CCCCC2)c1.
What is the InChIKey of 2-cyclohexyloxy-4-methoxybenzenesulfonamide?
The InChIKey is HFYKKOBVADQTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO4S/c1-17-11-7-8-13(19(14,15)16)12(9-11)18-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H2,14,15,16).
What are the key properties of 2-cyclohexyloxy-4-methoxybenzenesulfonamide?
2-cyclohexyloxy-4-methoxybenzenesulfonamide has a molecular weight of 285.36 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-4-methoxybenzenesulfonamide is sourced from PubChem (CID 69224689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).