3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine

C13H21NS — CID 104991519

IUPAC3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine
SMILESCc1cc(C(N)CCC2CCCC2)cs1
InChIInChI=1S/C13H21NS/c1-10-8-12(9-15-10)13(14)7-6-11-4-2-3-5-11/h8-9,11,13H,2-7,14H2,1H3
InChIKeyAEJRAFVRFNSXFG-UHFFFAOYSA-N
MW223.38 g/mol
LogP4.03
Rot. Bonds4

About 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine

3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine (PubChem CID 104991519) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine
PubChem CID104991519
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine
SMILESCc1cc(C(N)CCC2CCCC2)cs1
InChIInChI=1S/C13H21NS/c1-10-8-12(9-15-10)13(14)7-6-11-4-2-3-5-11/h8-9,11,13H,2-7,14H2,1H3
InChIKeyAEJRAFVRFNSXFG-UHFFFAOYSA-N
XLogP4.03
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 ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-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

Related Compounds

2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine
CID 55294440
3-cyclopentyl-1-(4-propan-2-ylphenyl)propan-1-amine
CID 43625227
1-(5-methylthiophen-3-yl)ethane-1,2-diamine
CID 55294445
1-(4-tert-butylphenyl)-3-cyclopentylpropan-1-amine
CID 43110325
2-cyclopentyl-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 104991619
1-(5-methylthiophen-3-yl)-2-(oxolan-2-yl)ethanamine
CID 65104547
3-cyclohexyl-1-phenylpropan-1-amine
CID 43110402
[cyclopentyl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105204481
1-(4-bromophenyl)-3-cyclopentylpropan-1-amine
CID 43184859
[(5-methylthiophen-3-yl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232352
1-(4-bromo-5-methylthiophen-2-yl)-3-cyclopentylpropan-1-amine
CID 102827024
1-(5-bromo-4-methylthiophen-2-yl)-3-cyclopentylpropan-1-amine
CID 79992064

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine (CID 104991519) is 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine is Cc1cc(C(N)CCC2CCCC2)cs1.
What is the InChIKey of 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine?
The InChIKey is AEJRAFVRFNSXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-10-8-12(9-15-10)13(14)7-6-11-4-2-3-5-11/h8-9,11,13H,2-7,14H2,1H3.
What are the key properties of 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine?
3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine has a molecular weight of 223.38 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(5-methylthiophen-3-yl)propan-1-amine is sourced from PubChem (CID 104991519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).