(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone

C20H17NO — CID 91678510

IUPAC(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone
SMILESCc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1N
InChIInChI=1S/C20H17NO/c1-14-13-18(11-12-19(14)21)20(22)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,21H2,1H3
InChIKeyAEYMQLVYWIWKQA-UHFFFAOYSA-N
MW287.36 g/mol
LogP4.48
Rot. Bonds3

About (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone

(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone (PubChem CID 91678510) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone.

Molecular Properties

Compound Name(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone
PubChem CID91678510
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone
SMILESCc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1N
InChIInChI=1S/C20H17NO/c1-14-13-18(11-12-19(14)21)20(22)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,21H2,1H3
InChIKeyAEYMQLVYWIWKQA-UHFFFAOYSA-N
XLogP4.48
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-amino-3-methylphenyl)benzoic acid
CID 23005198
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361
phenyl-(4-phenylphenyl)methanone
CID 155775877
(4-amino-3-methylphenyl)-(5-methylfuran-3-yl)methanone
CID 114823601
2-amino-5-benzoylbenzaldehyde
CID 58625138
ethane;[4-[4-[4-[4-(4-methylphenyl)phenyl]phenyl]phenyl]phenyl]-phenylmethanone
CID 159022602
(4-amino-3-methylphenyl)-(2-fluoro-3-methylphenyl)methanone
CID 81478857
4-[4-(4-amino-3-methylphenyl)phenyl]-2,2-dimethyl-4-oxobutanoic acid
CID 23549316
diphenylmethanone;(4-methylphenyl)-phenylmethanone
CID 69336781
2-amino-5-(4-amino-3-methylphenyl)benzoic acid
CID 143962907
(4-amino-3-methylphenyl)-[3-(trifluoromethoxy)phenyl]methanone
CID 116554006
4-amino-3-hydroxybenzoic acid;4-amino-3-methylbenzoic acid
CID 70365810

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone?
The IUPAC name of (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone (CID 91678510) is (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone.
What is the SMILES notation for (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone?
The canonical SMILES for (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone is Cc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1N.
What is the InChIKey of (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone?
The InChIKey is AEYMQLVYWIWKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-14-13-18(11-12-19(14)21)20(22)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,21H2,1H3.
What are the key properties of (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone?
(4-amino-3-methylphenyl)-(4-phenylphenyl)methanone has a molecular weight of 287.36 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-methylphenyl)-(4-phenylphenyl)methanone is sourced from PubChem (CID 91678510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).