4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine

C12H16N2 — CID 130943734

IUPAC4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CCC2=CCCC2)ccn1
InChIInChI=1S/C12H16N2/c13-12-9-11(7-8-14-12)6-5-10-3-1-2-4-10/h3,7-9H,1-2,4-6H2,(H2,13,14)
InChIKeyHKPYDVFKOGXMEM-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.71
Rot. Bonds3

About 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine

4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine (PubChem CID 130943734) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine
PubChem CID130943734
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CCC2=CCCC2)ccn1
InChIInChI=1S/C12H16N2/c13-12-9-11(7-8-14-12)6-5-10-3-1-2-4-10/h3,7-9H,1-2,4-6H2,(H2,13,14)
InChIKeyHKPYDVFKOGXMEM-UHFFFAOYSA-N
XLogP2.71
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-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 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine (CID 130943734) is 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine is Nc1cc(CCC2=CCCC2)ccn1.
What is the InChIKey of 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine?
The InChIKey is HKPYDVFKOGXMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c13-12-9-11(7-8-14-12)6-5-10-3-1-2-4-10/h3,7-9H,1-2,4-6H2,(H2,13,14).
What are the key properties of 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine?
4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine has a molecular weight of 188.27 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclopenten-1-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 130943734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).