2-(4-methylanilino)-1-phenylethanone

C15H15NO — CID 4230722

IUPAC2-(4-methylanilino)-1-phenylethanone
SMILESCc1ccc(NCC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-12-7-9-14(10-8-12)16-11-15(17)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3
InChIKeyFTVDOOKIZWBHOW-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.29
Rot. Bonds4

About 2-(4-methylanilino)-1-phenylethanone

2-(4-methylanilino)-1-phenylethanone (PubChem CID 4230722) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-(4-methylanilino)-1-phenylethanone.

Molecular Properties

Compound Name2-(4-methylanilino)-1-phenylethanone
PubChem CID4230722
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-(4-methylanilino)-1-phenylethanone
SMILESCc1ccc(NCC(=O)c2ccccc2)cc1
InChIInChI=1S/C15H15NO/c1-12-7-9-14(10-8-12)16-11-15(17)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3
InChIKeyFTVDOOKIZWBHOW-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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Related Compounds

1-(4-iodophenyl)-2-(4-methylanilino)ethanone
CID 35580992
2-(4-iodoanilino)-1-(4-methylphenyl)ethanone
CID 110823714
2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone
CID 2749284
2-(4-methylanilino)-N-[(Z)-(3-oxo-1,3-diphenylpropylidene)amino]acetamide
CID 46177792
2-(3,4-dimethylanilino)-1-(4-methylphenyl)ethanone
CID 82119902
2-(2-benzoylanilino)-1-(4-methylphenyl)ethanone
CID 110825945
2-anilino-1-(4-hydroxyphenyl)ethanone
CID 11379161
ethane;1-(4-methylanilino)propan-2-one
CID 143614458
1-(2,4-dimethylphenyl)-2-(4-methylanilino)ethanone
CID 82119914
1-(4-methoxy-3-methylphenyl)-2-(4-methylanilino)ethanone
CID 94279481
2-(4-methylanilino)-N-(1-phenylethyl)acetamide
CID 54814142
2-(4-methylanilino)-1-(1-methylindol-3-yl)ethanone
CID 110655429

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylanilino)-1-phenylethanone?
The IUPAC name of 2-(4-methylanilino)-1-phenylethanone (CID 4230722) is 2-(4-methylanilino)-1-phenylethanone.
What is the SMILES notation for 2-(4-methylanilino)-1-phenylethanone?
The canonical SMILES for 2-(4-methylanilino)-1-phenylethanone is Cc1ccc(NCC(=O)c2ccccc2)cc1.
What is the InChIKey of 2-(4-methylanilino)-1-phenylethanone?
The InChIKey is FTVDOOKIZWBHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-12-7-9-14(10-8-12)16-11-15(17)13-5-3-2-4-6-13/h2-10,16H,11H2,1H3.
What are the key properties of 2-(4-methylanilino)-1-phenylethanone?
2-(4-methylanilino)-1-phenylethanone 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-(4-methylanilino)-1-phenylethanone is sourced from PubChem (CID 4230722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).