2-anilino-1-(4-methylphenyl)ethanone

C15H15NO — CID 2564786

IUPAC2-anilino-1-(4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)CNc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-12-7-9-13(10-8-12)15(17)11-16-14-5-3-2-4-6-14/h2-10,16H,11H2,1H3
InChIKeyZQDKPOUDFAOKKS-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.29
Rot. Bonds4

About 2-anilino-1-(4-methylphenyl)ethanone

2-anilino-1-(4-methylphenyl)ethanone (PubChem CID 2564786) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-anilino-1-(4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-anilino-1-(4-methylphenyl)ethanone
PubChem CID2564786
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-anilino-1-(4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)CNc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-12-7-9-13(10-8-12)15(17)11-16-14-5-3-2-4-6-14/h2-10,16H,11H2,1H3
InChIKeyZQDKPOUDFAOKKS-UHFFFAOYSA-N
XLogP3.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-(4-methylphenyl)ethanone?
The IUPAC name of 2-anilino-1-(4-methylphenyl)ethanone (CID 2564786) is 2-anilino-1-(4-methylphenyl)ethanone.
What is the SMILES notation for 2-anilino-1-(4-methylphenyl)ethanone?
The canonical SMILES for 2-anilino-1-(4-methylphenyl)ethanone is Cc1ccc(C(=O)CNc2ccccc2)cc1.
What is the InChIKey of 2-anilino-1-(4-methylphenyl)ethanone?
The InChIKey is ZQDKPOUDFAOKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-12-7-9-13(10-8-12)15(17)11-16-14-5-3-2-4-6-14/h2-10,16H,11H2,1H3.
What are the key properties of 2-anilino-1-(4-methylphenyl)ethanone?
2-anilino-1-(4-methylphenyl)ethanone has a molecular weight of 225.29 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-(4-methylphenyl)ethanone is sourced from PubChem (CID 2564786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).