3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine

C13H21NS — CID 64514105

IUPAC3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine
SMILESCCC1CCC(N)(CCc2ccsc2)C1
InChIInChI=1S/C13H21NS/c1-2-11-3-6-13(14,9-11)7-4-12-5-8-15-10-12/h5,8,10-11H,2-4,6-7,9,14H2,1H3
InChIKeyDPQCKNFXRJRZMM-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.59
Rot. Bonds4

About 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine

3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine (PubChem CID 64514105) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine
PubChem CID64514105
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine
SMILESCCC1CCC(N)(CCc2ccsc2)C1
InChIInChI=1S/C13H21NS/c1-2-11-3-6-13(14,9-11)7-4-12-5-8-15-10-12/h5,8,10-11H,2-4,6-7,9,14H2,1H3
InChIKeyDPQCKNFXRJRZMM-UHFFFAOYSA-N
XLogP3.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine?
The IUPAC name of 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine (CID 64514105) is 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine is CCC1CCC(N)(CCc2ccsc2)C1.
What is the InChIKey of 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine?
The InChIKey is DPQCKNFXRJRZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-2-11-3-6-13(14,9-11)7-4-12-5-8-15-10-12/h5,8,10-11H,2-4,6-7,9,14H2,1H3.
What are the key properties of 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine?
3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine has a molecular weight of 223.38 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-thiophen-3-ylethyl)cyclopentan-1-amine is sourced from PubChem (CID 64514105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).