[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine

C14H21NO2S — CID 82501815

IUPAC[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine
SMILESCCS(=O)(=O)c1ccc(C2(CN)CCCC2)cc1
InChIInChI=1S/C14H21NO2S/c1-2-18(16,17)13-7-5-12(6-8-13)14(11-15)9-3-4-10-14/h5-8H,2-4,9-11,15H2,1H3
InChIKeyFTNOMVSALLEJGX-UHFFFAOYSA-N
MW267.39 g/mol
LogP2.25
Rot. Bonds4

About [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine

[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine (PubChem CID 82501815) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine
PubChem CID82501815
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC Name[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine
SMILESCCS(=O)(=O)c1ccc(C2(CN)CCCC2)cc1
InChIInChI=1S/C14H21NO2S/c1-2-18(16,17)13-7-5-12(6-8-13)14(11-15)9-3-4-10-14/h5-8H,2-4,9-11,15H2,1H3
InChIKeyFTNOMVSALLEJGX-UHFFFAOYSA-N
XLogP2.25
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine 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

[1-[4-[1-(methylsulfonylmethyl)cyclopropyl]phenyl]cyclohexyl]methanamine
CID 117113431
[1-(4-ethylphenyl)cyclopentyl]methanamine
CID 82491828
[1-[4-[1-(methylsulfonylmethyl)cyclopropyl]phenyl]cyclobutyl]methanamine
CID 117113179
2-[3-(4-ethylsulfonylphenyl)oxetan-3-yl]ethanamine
CID 116869588
[1-(4-propylphenyl)cyclohexyl]methanamine
CID 82495619
[4-[1-(aminomethyl)cyclobutyl]phenyl] methanesulfonate
CID 117391535
[1-(4-bromophenyl)cyclopentyl]methanamine
CID 43119067
N-[1-(aminomethyl)cyclopentyl]-4-ethylsulfonylbenzamide
CID 119567918
4-[1-(aminomethyl)cyclohexyl]benzenethiol
CID 154826557
[1-(4-chlorophenyl)cycloheptyl]methanamine
CID 28937852
[1-(4-tert-butylphenyl)cyclobutyl]methanamine
CID 43378542
[1-(4-fluoro-3-methylsulfonylphenyl)cyclopentyl]methanamine
CID 117431326

Frequently Asked Questions

What is the IUPAC name of [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine?
The IUPAC name of [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine (CID 82501815) is [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine?
The canonical SMILES for [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine is CCS(=O)(=O)c1ccc(C2(CN)CCCC2)cc1.
What is the InChIKey of [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine?
The InChIKey is FTNOMVSALLEJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-2-18(16,17)13-7-5-12(6-8-13)14(11-15)9-3-4-10-14/h5-8H,2-4,9-11,15H2,1H3.
What are the key properties of [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine?
[1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine has a molecular weight of 267.39 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylsulfonylphenyl)cyclopentyl]methanamine is sourced from PubChem (CID 82501815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).