6-nitro-2-phenylquinoline

C15H10N2O2 — CID 10999447

IUPAC6-nitro-2-phenylquinoline
SMILESO=[N+]([O-])c1ccc2nc(-c3ccccc3)ccc2c1
InChIInChI=1S/C15H10N2O2/c18-17(19)13-7-9-15-12(10-13)6-8-14(16-15)11-4-2-1-3-5-11/h1-10H
InChIKeyQGJPWQJZBMPMAT-UHFFFAOYSA-N
MW250.26 g/mol
LogP3.81
Rot. Bonds2

About 6-nitro-2-phenylquinoline

6-nitro-2-phenylquinoline (PubChem CID 10999447) has the molecular formula C15H10N2O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is 6-nitro-2-phenylquinoline.

Molecular Properties

Compound Name6-nitro-2-phenylquinoline
PubChem CID10999447
Molecular FormulaC15H10N2O2
Molecular Weight250.26 g/mol
Exact Mass250.07
IUPAC Name6-nitro-2-phenylquinoline
SMILESO=[N+]([O-])c1ccc2nc(-c3ccccc3)ccc2c1
InChIInChI=1S/C15H10N2O2/c18-17(19)13-7-9-15-12(10-13)6-8-14(16-15)11-4-2-1-3-5-11/h1-10H
InChIKeyQGJPWQJZBMPMAT-UHFFFAOYSA-N
XLogP3.81
TPSA56.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-nitro-2-phenylquinoline?
The IUPAC name of 6-nitro-2-phenylquinoline (CID 10999447) is 6-nitro-2-phenylquinoline.
What is the SMILES notation for 6-nitro-2-phenylquinoline?
The canonical SMILES for 6-nitro-2-phenylquinoline is O=[N+]([O-])c1ccc2nc(-c3ccccc3)ccc2c1.
What is the InChIKey of 6-nitro-2-phenylquinoline?
The InChIKey is QGJPWQJZBMPMAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O2/c18-17(19)13-7-9-15-12(10-13)6-8-14(16-15)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 6-nitro-2-phenylquinoline?
6-nitro-2-phenylquinoline has a molecular weight of 250.26 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-nitro-2-phenylquinoline is sourced from PubChem (CID 10999447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).