2-phenylbenzo[g]quinoline

C19H13N — CID 45113076

IUPAC2-phenylbenzo[g]quinoline
SMILESc1ccc(-c2ccc3cc4ccccc4cc3n2)cc1
InChIInChI=1S/C19H13N/c1-2-6-14(7-3-1)18-11-10-17-12-15-8-4-5-9-16(15)13-19(17)20-18/h1-13H
InChIKeyJAAWJQPVEFJQTP-UHFFFAOYSA-N
MW255.32 g/mol
LogP5.05
Rot. Bonds1

About 2-phenylbenzo[g]quinoline

2-phenylbenzo[g]quinoline (PubChem CID 45113076) has the molecular formula C19H13N and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-phenylbenzo[g]quinoline.

Molecular Properties

Compound Name2-phenylbenzo[g]quinoline
PubChem CID45113076
Molecular FormulaC19H13N
Molecular Weight255.32 g/mol
Exact Mass255.10
IUPAC Name2-phenylbenzo[g]quinoline
SMILESc1ccc(-c2ccc3cc4ccccc4cc3n2)cc1
InChIInChI=1S/C19H13N/c1-2-6-14(7-3-1)18-11-10-17-12-15-8-4-5-9-16(15)13-19(17)20-18/h1-13H
InChIKeyJAAWJQPVEFJQTP-UHFFFAOYSA-N
XLogP5.05
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.32
LogP ≤ 55.05
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-phenylbenzo[g]quinoline?
The IUPAC name of 2-phenylbenzo[g]quinoline (CID 45113076) is 2-phenylbenzo[g]quinoline.
What is the SMILES notation for 2-phenylbenzo[g]quinoline?
The canonical SMILES for 2-phenylbenzo[g]quinoline is c1ccc(-c2ccc3cc4ccccc4cc3n2)cc1.
What is the InChIKey of 2-phenylbenzo[g]quinoline?
The InChIKey is JAAWJQPVEFJQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N/c1-2-6-14(7-3-1)18-11-10-17-12-15-8-4-5-9-16(15)13-19(17)20-18/h1-13H.
What are the key properties of 2-phenylbenzo[g]quinoline?
2-phenylbenzo[g]quinoline has a molecular weight of 255.32 g/mol, XLogP of 5.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylbenzo[g]quinoline is sourced from PubChem (CID 45113076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).