N-(1,3-thiazol-5-ylmethyl)cyclopentanamine

C9H14N2S — CID 62759023

IUPACN-(1,3-thiazol-5-ylmethyl)cyclopentanamine
SMILESc1ncc(CNC2CCCC2)s1
InChIInChI=1S/C9H14N2S/c1-2-4-8(3-1)11-6-9-5-10-7-12-9/h5,7-8,11H,1-4,6H2
InChIKeyYSAOXKMHLHLENR-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.18
Rot. Bonds3

About N-(1,3-thiazol-5-ylmethyl)cyclopentanamine

N-(1,3-thiazol-5-ylmethyl)cyclopentanamine (PubChem CID 62759023) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is N-(1,3-thiazol-5-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(1,3-thiazol-5-ylmethyl)cyclopentanamine
PubChem CID62759023
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC NameN-(1,3-thiazol-5-ylmethyl)cyclopentanamine
SMILESc1ncc(CNC2CCCC2)s1
InChIInChI=1S/C9H14N2S/c1-2-4-8(3-1)11-6-9-5-10-7-12-9/h5,7-8,11H,1-4,6H2
InChIKeyYSAOXKMHLHLENR-UHFFFAOYSA-N
XLogP2.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1,3-thiazol-5-ylmethyl)cyclopentanamine 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 N-(1,3-thiazol-5-ylmethyl)cyclopentanamine?
The IUPAC name of N-(1,3-thiazol-5-ylmethyl)cyclopentanamine (CID 62759023) is N-(1,3-thiazol-5-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(1,3-thiazol-5-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(1,3-thiazol-5-ylmethyl)cyclopentanamine is c1ncc(CNC2CCCC2)s1.
What is the InChIKey of N-(1,3-thiazol-5-ylmethyl)cyclopentanamine?
The InChIKey is YSAOXKMHLHLENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-2-4-8(3-1)11-6-9-5-10-7-12-9/h5,7-8,11H,1-4,6H2.
What are the key properties of N-(1,3-thiazol-5-ylmethyl)cyclopentanamine?
N-(1,3-thiazol-5-ylmethyl)cyclopentanamine has a molecular weight of 182.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-5-ylmethyl)cyclopentanamine is sourced from PubChem (CID 62759023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).