9-benzylidene-3-methylindeno[2,1-c]pyridine

C20H15N — CID 1427170

IUPAC9-benzylidene-3-methylindeno[2,1-c]pyridine
SMILESCc1cc2c(cn1)C(=Cc1ccccc1)c1ccccc1-2
InChIInChI=1S/C20H15N/c1-14-11-18-16-9-5-6-10-17(16)19(20(18)13-21-14)12-15-7-3-2-4-8-15/h2-13H,1H3
InChIKeyABDZGGVFJYHTBS-UHFFFAOYSA-N
MW269.35 g/mol
LogP4.96
Rot. Bonds1

About 9-benzylidene-3-methylindeno[2,1-c]pyridine

9-benzylidene-3-methylindeno[2,1-c]pyridine (PubChem CID 1427170) has the molecular formula C20H15N and a molecular weight of 269.35 g/mol. Its IUPAC name is 9-benzylidene-3-methylindeno[2,1-c]pyridine.

Molecular Properties

Compound Name9-benzylidene-3-methylindeno[2,1-c]pyridine
PubChem CID1427170
Molecular FormulaC20H15N
Molecular Weight269.35 g/mol
Exact Mass269.12
IUPAC Name9-benzylidene-3-methylindeno[2,1-c]pyridine
SMILESCc1cc2c(cn1)C(=Cc1ccccc1)c1ccccc1-2
InChIInChI=1S/C20H15N/c1-14-11-18-16-9-5-6-10-17(16)19(20(18)13-21-14)12-15-7-3-2-4-8-15/h2-13H,1H3
InChIKeyABDZGGVFJYHTBS-UHFFFAOYSA-N
XLogP4.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 9-benzylidene-3-methylindeno[2,1-c]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 9-benzylidene-3-methylindeno[2,1-c]pyridine?
The IUPAC name of 9-benzylidene-3-methylindeno[2,1-c]pyridine (CID 1427170) is 9-benzylidene-3-methylindeno[2,1-c]pyridine.
What is the SMILES notation for 9-benzylidene-3-methylindeno[2,1-c]pyridine?
The canonical SMILES for 9-benzylidene-3-methylindeno[2,1-c]pyridine is Cc1cc2c(cn1)C(=Cc1ccccc1)c1ccccc1-2.
What is the InChIKey of 9-benzylidene-3-methylindeno[2,1-c]pyridine?
The InChIKey is ABDZGGVFJYHTBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N/c1-14-11-18-16-9-5-6-10-17(16)19(20(18)13-21-14)12-15-7-3-2-4-8-15/h2-13H,1H3.
What are the key properties of 9-benzylidene-3-methylindeno[2,1-c]pyridine?
9-benzylidene-3-methylindeno[2,1-c]pyridine has a molecular weight of 269.35 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-benzylidene-3-methylindeno[2,1-c]pyridine is sourced from PubChem (CID 1427170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).