3-cyclopent-2-en-1-ylpyridine

C10H11N — CID 131859585

IUPAC3-cyclopent-2-en-1-ylpyridine
SMILESC1=CC(c2cccnc2)CC1
InChIInChI=1S/C10H11N/c1-2-5-9(4-1)10-6-3-7-11-8-10/h1,3-4,6-9H,2,5H2
InChIKeyJWUZBNZBYPEJFC-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.52
Rot. Bonds1

About 3-cyclopent-2-en-1-ylpyridine

3-cyclopent-2-en-1-ylpyridine (PubChem CID 131859585) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 3-cyclopent-2-en-1-ylpyridine.

Molecular Properties

Compound Name3-cyclopent-2-en-1-ylpyridine
PubChem CID131859585
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name3-cyclopent-2-en-1-ylpyridine
SMILESC1=CC(c2cccnc2)CC1
InChIInChI=1S/C10H11N/c1-2-5-9(4-1)10-6-3-7-11-8-10/h1,3-4,6-9H,2,5H2
InChIKeyJWUZBNZBYPEJFC-UHFFFAOYSA-N
XLogP2.52
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopent-2-en-1-ylpyridine?
The IUPAC name of 3-cyclopent-2-en-1-ylpyridine (CID 131859585) is 3-cyclopent-2-en-1-ylpyridine.
What is the SMILES notation for 3-cyclopent-2-en-1-ylpyridine?
The canonical SMILES for 3-cyclopent-2-en-1-ylpyridine is C1=CC(c2cccnc2)CC1.
What is the InChIKey of 3-cyclopent-2-en-1-ylpyridine?
The InChIKey is JWUZBNZBYPEJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-2-5-9(4-1)10-6-3-7-11-8-10/h1,3-4,6-9H,2,5H2.
What are the key properties of 3-cyclopent-2-en-1-ylpyridine?
3-cyclopent-2-en-1-ylpyridine has a molecular weight of 145.20 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopent-2-en-1-ylpyridine is sourced from PubChem (CID 131859585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).