N-[4-(methylamino)phenyl]cyclohexanesulfonamide

C13H20N2O2S — CID 61064598

IUPACN-[4-(methylamino)phenyl]cyclohexanesulfonamide
SMILESCNc1ccc(NS(=O)(=O)C2CCCCC2)cc1
InChIInChI=1S/C13H20N2O2S/c1-14-11-7-9-12(10-8-11)15-18(16,17)13-5-3-2-4-6-13/h7-10,13-15H,2-6H2,1H3
InChIKeyGXWNSWRPHPUEHR-UHFFFAOYSA-N
MW268.38 g/mol
LogP2.80
Rot. Bonds4

About N-[4-(methylamino)phenyl]cyclohexanesulfonamide

N-[4-(methylamino)phenyl]cyclohexanesulfonamide (PubChem CID 61064598) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is N-[4-(methylamino)phenyl]cyclohexanesulfonamide.

Molecular Properties

Compound NameN-[4-(methylamino)phenyl]cyclohexanesulfonamide
PubChem CID61064598
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC NameN-[4-(methylamino)phenyl]cyclohexanesulfonamide
SMILESCNc1ccc(NS(=O)(=O)C2CCCCC2)cc1
InChIInChI=1S/C13H20N2O2S/c1-14-11-7-9-12(10-8-11)15-18(16,17)13-5-3-2-4-6-13/h7-10,13-15H,2-6H2,1H3
InChIKeyGXWNSWRPHPUEHR-UHFFFAOYSA-N
XLogP2.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide
CID 105361013
N-(4-formylphenyl)cyclopentanesulfonamide
CID 106912880
N-[4-[(cyclopropylamino)methyl]phenyl]cyclohexanesulfonamide
CID 106911163
N-(3-amino-4-ethylphenyl)cyclohexanesulfonamide
CID 61065811
N-[4-(3-hydroxyprop-1-ynyl)phenyl]cyclohexanesulfonamide
CID 61058963
N-[4-(1-aminoethyl)phenyl]cyclopropanesulfonamide
CID 64553254
3-[4-(cyclopentylsulfonylamino)phenyl]propanoic acid
CID 105360943
N-(4-piperazin-1-ylphenyl)cyclopentanesulfonamide
CID 105360645
N-(3-aminophenyl)cyclopentanesulfonamide
CID 105360531
N-[4-(cyanomethoxy)phenyl]cyclopentanesulfonamide
CID 115606497
N-cycloheptyl-4-(methylamino)benzenesulfonamide
CID 15049673
2-[4-(cyclopentylsulfonylamino)phenyl]-N'-hydroxyethanimidamide
CID 105361608

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylamino)phenyl]cyclohexanesulfonamide?
The IUPAC name of N-[4-(methylamino)phenyl]cyclohexanesulfonamide (CID 61064598) is N-[4-(methylamino)phenyl]cyclohexanesulfonamide.
What is the SMILES notation for N-[4-(methylamino)phenyl]cyclohexanesulfonamide?
The canonical SMILES for N-[4-(methylamino)phenyl]cyclohexanesulfonamide is CNc1ccc(NS(=O)(=O)C2CCCCC2)cc1.
What is the InChIKey of N-[4-(methylamino)phenyl]cyclohexanesulfonamide?
The InChIKey is GXWNSWRPHPUEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c1-14-11-7-9-12(10-8-11)15-18(16,17)13-5-3-2-4-6-13/h7-10,13-15H,2-6H2,1H3.
What are the key properties of N-[4-(methylamino)phenyl]cyclohexanesulfonamide?
N-[4-(methylamino)phenyl]cyclohexanesulfonamide has a molecular weight of 268.38 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylamino)phenyl]cyclohexanesulfonamide is sourced from PubChem (CID 61064598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).