N-(2-amino-4-methylphenyl)cyclopentanesulfonamide

C12H18N2O2S — CID 105360548

IUPACN-(2-amino-4-methylphenyl)cyclopentanesulfonamide
SMILESCc1ccc(NS(=O)(=O)C2CCCC2)c(N)c1
InChIInChI=1S/C12H18N2O2S/c1-9-6-7-12(11(13)8-9)14-17(15,16)10-4-2-3-5-10/h6-8,10,14H,2-5,13H2,1H3
InChIKeyBBSUCYRDICWOLU-UHFFFAOYSA-N
MW254.35 g/mol
LogP2.26
Rot. Bonds3

About N-(2-amino-4-methylphenyl)cyclopentanesulfonamide

N-(2-amino-4-methylphenyl)cyclopentanesulfonamide (PubChem CID 105360548) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)cyclopentanesulfonamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)cyclopentanesulfonamide
PubChem CID105360548
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(2-amino-4-methylphenyl)cyclopentanesulfonamide
SMILESCc1ccc(NS(=O)(=O)C2CCCC2)c(N)c1
InChIInChI=1S/C12H18N2O2S/c1-9-6-7-12(11(13)8-9)14-17(15,16)10-4-2-3-5-10/h6-8,10,14H,2-5,13H2,1H3
InChIKeyBBSUCYRDICWOLU-UHFFFAOYSA-N
XLogP2.26
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-4-(cyclohexylsulfonylamino)benzoic acid
CID 63117178
N-(5-amino-2-bromo-4-methylphenyl)cyclohexanesulfonamide
CID 104814646
4-methyl-1-N-(propan-2-ylsulfamoyl)benzene-1,2-diamine
CID 114804316
N-(8-amino-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)cyclopentanesulfonamide
CID 105360587
N-[2-(2,4-dimethylanilino)-3,4-difluorophenyl]cyclohexanesulfonamide
CID 143758056
N-[4-(3-aminoprop-1-ynyl)-2-methylphenyl]cyclopentanesulfonamide
CID 105361546
N-(5-amino-2,4-dimethylphenyl)cyclopropanesulfonamide
CID 104757256
N-(2-amino-4,5-dimethylphenyl)oxane-4-sulfonamide
CID 55037574
N-(2-amino-4-methylphenyl)-4-fluorobenzenesulfonamide
CID 43259163
N-(2-amino-6-methylphenyl)cyclohexanesulfonamide
CID 61065471
N-(5-bromo-2-methylphenyl)cyclopentanesulfonamide
CID 115606541
N-(2-fluoro-4-methylphenyl)piperidine-3-sulfonamide
CID 43114273

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)cyclopentanesulfonamide?
The IUPAC name of N-(2-amino-4-methylphenyl)cyclopentanesulfonamide (CID 105360548) is N-(2-amino-4-methylphenyl)cyclopentanesulfonamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)cyclopentanesulfonamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)cyclopentanesulfonamide is Cc1ccc(NS(=O)(=O)C2CCCC2)c(N)c1.
What is the InChIKey of N-(2-amino-4-methylphenyl)cyclopentanesulfonamide?
The InChIKey is BBSUCYRDICWOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-9-6-7-12(11(13)8-9)14-17(15,16)10-4-2-3-5-10/h6-8,10,14H,2-5,13H2,1H3.
What are the key properties of N-(2-amino-4-methylphenyl)cyclopentanesulfonamide?
N-(2-amino-4-methylphenyl)cyclopentanesulfonamide has a molecular weight of 254.35 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)cyclopentanesulfonamide is sourced from PubChem (CID 105360548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).