2-(10-phenylanthracen-9-yl)pyridine

C25H17N — CID 88943773

IUPAC2-(10-phenylanthracen-9-yl)pyridine
SMILESc1ccc(-c2c3ccccc3c(-c3ccccn3)c3ccccc23)cc1
InChIInChI=1S/C25H17N/c1-2-10-18(11-3-1)24-19-12-4-6-14-21(19)25(23-16-8-9-17-26-23)22-15-7-5-13-20(22)24/h1-17H
InChIKeyDLHJPQLXFISCPP-UHFFFAOYSA-N
MW331.42 g/mol
LogP6.72
Rot. Bonds2

About 2-(10-phenylanthracen-9-yl)pyridine

2-(10-phenylanthracen-9-yl)pyridine (PubChem CID 88943773) has the molecular formula C25H17N and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-(10-phenylanthracen-9-yl)pyridine.

Molecular Properties

Compound Name2-(10-phenylanthracen-9-yl)pyridine
PubChem CID88943773
Molecular FormulaC25H17N
Molecular Weight331.42 g/mol
Exact Mass331.14
IUPAC Name2-(10-phenylanthracen-9-yl)pyridine
SMILESc1ccc(-c2c3ccccc3c(-c3ccccn3)c3ccccc23)cc1
InChIInChI=1S/C25H17N/c1-2-10-18(11-3-1)24-19-12-4-6-14-21(19)25(23-16-8-9-17-26-23)22-15-7-5-13-20(22)24/h1-17H
InChIKeyDLHJPQLXFISCPP-UHFFFAOYSA-N
XLogP6.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.42
LogP ≤ 56.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(10-phenylanthracen-9-yl)pyridine?
The IUPAC name of 2-(10-phenylanthracen-9-yl)pyridine (CID 88943773) is 2-(10-phenylanthracen-9-yl)pyridine.
What is the SMILES notation for 2-(10-phenylanthracen-9-yl)pyridine?
The canonical SMILES for 2-(10-phenylanthracen-9-yl)pyridine is c1ccc(-c2c3ccccc3c(-c3ccccn3)c3ccccc23)cc1.
What is the InChIKey of 2-(10-phenylanthracen-9-yl)pyridine?
The InChIKey is DLHJPQLXFISCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17N/c1-2-10-18(11-3-1)24-19-12-4-6-14-21(19)25(23-16-8-9-17-26-23)22-15-7-5-13-20(22)24/h1-17H.
What are the key properties of 2-(10-phenylanthracen-9-yl)pyridine?
2-(10-phenylanthracen-9-yl)pyridine has a molecular weight of 331.42 g/mol, XLogP of 6.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(10-phenylanthracen-9-yl)pyridine is sourced from PubChem (CID 88943773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).