2-methylidene-5-phenyl-3H-pyridine

C12H11N — CID 167214063

IUPAC2-methylidene-5-phenyl-3H-pyridine
SMILESC=C1CC=C(c2ccccc2)C=N1
InChIInChI=1S/C12H11N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h2-6,8-9H,1,7H2
InChIKeyDGOKLJTYVHQADC-UHFFFAOYSA-N
MW169.23 g/mol
LogP3.06
Rot. Bonds1

About 2-methylidene-5-phenyl-3H-pyridine

2-methylidene-5-phenyl-3H-pyridine (PubChem CID 167214063) has the molecular formula C12H11N and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-methylidene-5-phenyl-3H-pyridine.

Molecular Properties

Compound Name2-methylidene-5-phenyl-3H-pyridine
PubChem CID167214063
Molecular FormulaC12H11N
Molecular Weight169.23 g/mol
Exact Mass169.09
IUPAC Name2-methylidene-5-phenyl-3H-pyridine
SMILESC=C1CC=C(c2ccccc2)C=N1
InChIInChI=1S/C12H11N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h2-6,8-9H,1,7H2
InChIKeyDGOKLJTYVHQADC-UHFFFAOYSA-N
XLogP3.06
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methylidene-5-phenyl-3H-pyridine 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 2-methylidene-5-phenyl-3H-pyridine?
The IUPAC name of 2-methylidene-5-phenyl-3H-pyridine (CID 167214063) is 2-methylidene-5-phenyl-3H-pyridine.
What is the SMILES notation for 2-methylidene-5-phenyl-3H-pyridine?
The canonical SMILES for 2-methylidene-5-phenyl-3H-pyridine is C=C1CC=C(c2ccccc2)C=N1.
What is the InChIKey of 2-methylidene-5-phenyl-3H-pyridine?
The InChIKey is DGOKLJTYVHQADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h2-6,8-9H,1,7H2.
What are the key properties of 2-methylidene-5-phenyl-3H-pyridine?
2-methylidene-5-phenyl-3H-pyridine has a molecular weight of 169.23 g/mol, XLogP of 3.06, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-5-phenyl-3H-pyridine is sourced from PubChem (CID 167214063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).