1-(2-aminophenyl)quinolin-4-one

C15H12N2O — CID 15712134

IUPAC1-(2-aminophenyl)quinolin-4-one
SMILESNc1ccccc1-n1ccc(=O)c2ccccc21
InChIInChI=1S/C15H12N2O/c16-12-6-2-4-8-14(12)17-10-9-15(18)11-5-1-3-7-13(11)17/h1-10H,16H2
InChIKeyOIXNDWMCISIYGM-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.57
Rot. Bonds1

About 1-(2-aminophenyl)quinolin-4-one

1-(2-aminophenyl)quinolin-4-one (PubChem CID 15712134) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 1-(2-aminophenyl)quinolin-4-one.

Molecular Properties

Compound Name1-(2-aminophenyl)quinolin-4-one
PubChem CID15712134
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name1-(2-aminophenyl)quinolin-4-one
SMILESNc1ccccc1-n1ccc(=O)c2ccccc21
InChIInChI=1S/C15H12N2O/c16-12-6-2-4-8-14(12)17-10-9-15(18)11-5-1-3-7-13(11)17/h1-10H,16H2
InChIKeyOIXNDWMCISIYGM-UHFFFAOYSA-N
XLogP2.57
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)quinolin-4-one?
The IUPAC name of 1-(2-aminophenyl)quinolin-4-one (CID 15712134) is 1-(2-aminophenyl)quinolin-4-one.
What is the SMILES notation for 1-(2-aminophenyl)quinolin-4-one?
The canonical SMILES for 1-(2-aminophenyl)quinolin-4-one is Nc1ccccc1-n1ccc(=O)c2ccccc21.
What is the InChIKey of 1-(2-aminophenyl)quinolin-4-one?
The InChIKey is OIXNDWMCISIYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c16-12-6-2-4-8-14(12)17-10-9-15(18)11-5-1-3-7-13(11)17/h1-10H,16H2.
What are the key properties of 1-(2-aminophenyl)quinolin-4-one?
1-(2-aminophenyl)quinolin-4-one has a molecular weight of 236.27 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)quinolin-4-one is sourced from PubChem (CID 15712134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).