(3-aminophenyl)-(2-phenylphenyl)methanone

C19H15NO — CID 159233114

IUPAC(3-aminophenyl)-(2-phenylphenyl)methanone
SMILESNc1cccc(C(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C19H15NO/c20-16-10-6-9-15(13-16)19(21)18-12-5-4-11-17(18)14-7-2-1-3-8-14/h1-13H,20H2
InChIKeyKTDKPBWVCVNJIM-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.17
Rot. Bonds3

About (3-aminophenyl)-(2-phenylphenyl)methanone

(3-aminophenyl)-(2-phenylphenyl)methanone (PubChem CID 159233114) has the molecular formula C19H15NO and a molecular weight of 273.34 g/mol. Its IUPAC name is (3-aminophenyl)-(2-phenylphenyl)methanone.

Molecular Properties

Compound Name(3-aminophenyl)-(2-phenylphenyl)methanone
PubChem CID159233114
Molecular FormulaC19H15NO
Molecular Weight273.34 g/mol
Exact Mass273.12
IUPAC Name(3-aminophenyl)-(2-phenylphenyl)methanone
SMILESNc1cccc(C(=O)c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C19H15NO/c20-16-10-6-9-15(13-16)19(21)18-12-5-4-11-17(18)14-7-2-1-3-8-14/h1-13H,20H2
InChIKeyKTDKPBWVCVNJIM-UHFFFAOYSA-N
XLogP4.17
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-aminophenyl)-(2-phenylphenyl)methanone?
The IUPAC name of (3-aminophenyl)-(2-phenylphenyl)methanone (CID 159233114) is (3-aminophenyl)-(2-phenylphenyl)methanone.
What is the SMILES notation for (3-aminophenyl)-(2-phenylphenyl)methanone?
The canonical SMILES for (3-aminophenyl)-(2-phenylphenyl)methanone is Nc1cccc(C(=O)c2ccccc2-c2ccccc2)c1.
What is the InChIKey of (3-aminophenyl)-(2-phenylphenyl)methanone?
The InChIKey is KTDKPBWVCVNJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c20-16-10-6-9-15(13-16)19(21)18-12-5-4-11-17(18)14-7-2-1-3-8-14/h1-13H,20H2.
What are the key properties of (3-aminophenyl)-(2-phenylphenyl)methanone?
(3-aminophenyl)-(2-phenylphenyl)methanone has a molecular weight of 273.34 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminophenyl)-(2-phenylphenyl)methanone is sourced from PubChem (CID 159233114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).