N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide

C13H20N2O2S — CID 105361013

IUPACN-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide
SMILESCC(N)c1ccc(NS(=O)(=O)C2CCCC2)cc1
InChIInChI=1S/C13H20N2O2S/c1-10(14)11-6-8-12(9-7-11)15-18(16,17)13-4-2-3-5-13/h6-10,13,15H,2-5,14H2,1H3
InChIKeyWXHGLCXNAYUNII-UHFFFAOYSA-N
MW268.38 g/mol
LogP2.39
Rot. Bonds4

About N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide

N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide (PubChem CID 105361013) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide.

Molecular Properties

Compound NameN-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide
PubChem CID105361013
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC NameN-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide
SMILESCC(N)c1ccc(NS(=O)(=O)C2CCCC2)cc1
InChIInChI=1S/C13H20N2O2S/c1-10(14)11-6-8-12(9-7-11)15-18(16,17)13-4-2-3-5-13/h6-10,13,15H,2-5,14H2,1H3
InChIKeyWXHGLCXNAYUNII-UHFFFAOYSA-N
XLogP2.39
TPSA72.19 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 ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(1-aminoethyl)phenyl]cyclopropanesulfonamide
CID 64553254
N-[4-(methylamino)phenyl]cyclohexanesulfonamide
CID 61064598
N-[4-[1-(ethylamino)ethyl]phenyl]cyclopropanesulfonamide
CID 64553467
N-(4-formylphenyl)cyclopentanesulfonamide
CID 106912880
N-(3-amino-4-ethylphenyl)cyclohexanesulfonamide
CID 61065811
3-[4-(cyclopropylsulfonylamino)phenyl]butanoic acid
CID 113420004
N-[3-[1-(ethylamino)ethyl]phenyl]cyclohexanesulfonamide
CID 61064761
N-[4-[(cyclopropylamino)methyl]phenyl]cyclohexanesulfonamide
CID 106911163
N-(3-aminophenyl)cyclopentanesulfonamide
CID 105360531
N-[4-[(1S)-1-aminoethyl]phenyl]propane-1-sulfonamide
CID 30120117
4-(1-aminoethyl)-N-cycloheptylbenzenesulfonamide
CID 43167801
N-(4-propan-2-ylphenyl)pyrrolidine-3-sulfonamide
CID 65421563

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide?
The IUPAC name of N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide (CID 105361013) is N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide.
What is the SMILES notation for N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide?
The canonical SMILES for N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide is CC(N)c1ccc(NS(=O)(=O)C2CCCC2)cc1.
What is the InChIKey of N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide?
The InChIKey is WXHGLCXNAYUNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c1-10(14)11-6-8-12(9-7-11)15-18(16,17)13-4-2-3-5-13/h6-10,13,15H,2-5,14H2,1H3.
What are the key properties of N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide?
N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide has a molecular weight of 268.38 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-aminoethyl)phenyl]cyclopentanesulfonamide is sourced from PubChem (CID 105361013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).