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

C15H15NO — CID 22285788

IUPAC(2-amino-3-methylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2cccc(C)c2N)cc1
InChIInChI=1S/C15H15NO/c1-10-6-8-12(9-7-10)15(17)13-5-3-4-11(2)14(13)16/h3-9H,16H2,1-2H3
InChIKeyANOADPOPRJGAQG-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.12
Rot. Bonds2

About (2-amino-3-methylphenyl)-(4-methylphenyl)methanone

(2-amino-3-methylphenyl)-(4-methylphenyl)methanone (PubChem CID 22285788) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is (2-amino-3-methylphenyl)-(4-methylphenyl)methanone.

Molecular Properties

Compound Name(2-amino-3-methylphenyl)-(4-methylphenyl)methanone
PubChem CID22285788
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name(2-amino-3-methylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2cccc(C)c2N)cc1
InChIInChI=1S/C15H15NO/c1-10-6-8-12(9-7-10)15(17)13-5-3-4-11(2)14(13)16/h3-9H,16H2,1-2H3
InChIKeyANOADPOPRJGAQG-UHFFFAOYSA-N
XLogP3.12
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(2-methylphenyl)-(4-methylphenyl)methanone
CID 6613295
(1-aminonaphthalen-2-yl)-(4-methylphenyl)methanone
CID 67495002
2-amino-3-methylbenzoic acid;azane
CID 69400013
2-amino-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 28798437
4-(2-hydroxy-3-methylbenzoyl)benzamide
CID 142582997
(2-amino-3,5-dimethylphenyl)-phenylmethanone
CID 70126178
(2-methylphenyl)methyl 2-(4-methylbenzoyl)benzoate
CID 7718093
4-(2,3-dimethylbenzoyl)benzoic acid
CID 175457920
3-(2-amino-3-methylphenyl)-3-oxopropanoic acid
CID 105446835
bromo 2-amino-3-methylbenzoate
CID 174426723
(2-amino-5-fluorophenyl)-(4-methylphenyl)methanone
CID 13408102
(2,3-dimethylphenyl)-(4-fluorophenyl)methanone
CID 43159951

Frequently Asked Questions

What is the IUPAC name of (2-amino-3-methylphenyl)-(4-methylphenyl)methanone?
The IUPAC name of (2-amino-3-methylphenyl)-(4-methylphenyl)methanone (CID 22285788) is (2-amino-3-methylphenyl)-(4-methylphenyl)methanone.
What is the SMILES notation for (2-amino-3-methylphenyl)-(4-methylphenyl)methanone?
The canonical SMILES for (2-amino-3-methylphenyl)-(4-methylphenyl)methanone is Cc1ccc(C(=O)c2cccc(C)c2N)cc1.
What is the InChIKey of (2-amino-3-methylphenyl)-(4-methylphenyl)methanone?
The InChIKey is ANOADPOPRJGAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-10-6-8-12(9-7-10)15(17)13-5-3-4-11(2)14(13)16/h3-9H,16H2,1-2H3.
What are the key properties of (2-amino-3-methylphenyl)-(4-methylphenyl)methanone?
(2-amino-3-methylphenyl)-(4-methylphenyl)methanone has a molecular weight of 225.29 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-methylphenyl)-(4-methylphenyl)methanone is sourced from PubChem (CID 22285788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).