1-(thiolan-3-yl)cyclopentan-1-amine

C9H17NS — CID 82653360

IUPAC1-(thiolan-3-yl)cyclopentan-1-amine
SMILESNC1(C2CCSC2)CCCC1
InChIInChI=1S/C9H17NS/c10-9(4-1-2-5-9)8-3-6-11-7-8/h8H,1-7,10H2
InChIKeyWAUMWEOGIWDQSJ-UHFFFAOYSA-N
MW171.31 g/mol
LogP2.01
Rot. Bonds1

About 1-(thiolan-3-yl)cyclopentan-1-amine

1-(thiolan-3-yl)cyclopentan-1-amine (PubChem CID 82653360) has the molecular formula C9H17NS and a molecular weight of 171.31 g/mol. Its IUPAC name is 1-(thiolan-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(thiolan-3-yl)cyclopentan-1-amine
PubChem CID82653360
Molecular FormulaC9H17NS
Molecular Weight171.31 g/mol
Exact Mass171.11
IUPAC Name1-(thiolan-3-yl)cyclopentan-1-amine
SMILESNC1(C2CCSC2)CCCC1
InChIInChI=1S/C9H17NS/c10-9(4-1-2-5-9)8-3-6-11-7-8/h8H,1-7,10H2
InChIKeyWAUMWEOGIWDQSJ-UHFFFAOYSA-N
XLogP2.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.31
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(thiolan-3-yl)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 1-(thiolan-3-yl)cyclopentan-1-amine?
The IUPAC name of 1-(thiolan-3-yl)cyclopentan-1-amine (CID 82653360) is 1-(thiolan-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(thiolan-3-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(thiolan-3-yl)cyclopentan-1-amine is NC1(C2CCSC2)CCCC1.
What is the InChIKey of 1-(thiolan-3-yl)cyclopentan-1-amine?
The InChIKey is WAUMWEOGIWDQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NS/c10-9(4-1-2-5-9)8-3-6-11-7-8/h8H,1-7,10H2.
What are the key properties of 1-(thiolan-3-yl)cyclopentan-1-amine?
1-(thiolan-3-yl)cyclopentan-1-amine has a molecular weight of 171.31 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(thiolan-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 82653360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).