2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone

C20H17NO2 — CID 121436837

IUPAC2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone
SMILESNc1ccccc1-c1ccc(C(O)C(=O)c2ccccc2)cc1
InChIInChI=1S/C20H17NO2/c21-18-9-5-4-8-17(18)14-10-12-16(13-11-14)20(23)19(22)15-6-2-1-3-7-15/h1-13,20,23H,21H2
InChIKeyNLBBQCKLHNGCSR-UHFFFAOYSA-N
MW303.36 g/mol
LogP3.85
Rot. Bonds4

About 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone

2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone (PubChem CID 121436837) has the molecular formula C20H17NO2 and a molecular weight of 303.36 g/mol. Its IUPAC name is 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone.

Molecular Properties

Compound Name2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone
PubChem CID121436837
Molecular FormulaC20H17NO2
Molecular Weight303.36 g/mol
Exact Mass303.13
IUPAC Name2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone
SMILESNc1ccccc1-c1ccc(C(O)C(=O)c2ccccc2)cc1
InChIInChI=1S/C20H17NO2/c21-18-9-5-4-8-17(18)14-10-12-16(13-11-14)20(23)19(22)15-6-2-1-3-7-15/h1-13,20,23H,21H2
InChIKeyNLBBQCKLHNGCSR-UHFFFAOYSA-N
XLogP3.85
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-hydroxy-1,2-diphenylethanone
CID 159399559
formaldehyde;bis(2-hydroxy-1,2-diphenylethanone)
CID 174440021
deuterium monohydride;2-hydroxy-1,2-diphenylethanone
CID 158356694
2-hydroxy-1-phenyl-2-(4-propan-2-ylphenyl)ethanone
CID 23513084
2-hydroxy-1,2-diphenylethanone;silyloxysilane
CID 173133276
2-hydroxy-1,2-diphenylethanone;prop-2-enoic acid
CID 57368066
2-hydroxy-1,2-diphenylethanone;propanoic acid
CID 159329247
2-[4-(2-bromoethyl)phenyl]-2-hydroxy-1-phenylethanone
CID 86260257
palladium(2+);2-phenylaniline
CID 175718665
2-phenylaniline;hydrochloride
CID 5284347
CID 159962191
CID 159962191
2-hydroxy-1-phenyl-2-[4-[4-[(2-phenylphenyl)methyl]piperazin-1-yl]phenyl]ethanone
CID 68584959

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone?
The IUPAC name of 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone (CID 121436837) is 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone.
What is the SMILES notation for 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone?
The canonical SMILES for 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone is Nc1ccccc1-c1ccc(C(O)C(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone?
The InChIKey is NLBBQCKLHNGCSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO2/c21-18-9-5-4-8-17(18)14-10-12-16(13-11-14)20(23)19(22)15-6-2-1-3-7-15/h1-13,20,23H,21H2.
What are the key properties of 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone?
2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone has a molecular weight of 303.36 g/mol, XLogP of 3.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminophenyl)phenyl]-2-hydroxy-1-phenylethanone is sourced from PubChem (CID 121436837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).