2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide

C19H22N2O2 — CID 113168520

IUPAC2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(C)c1)c1cc(C)cc(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-6-5-7-17(9-13)20-19(23)12-21(16(4)22)18-10-14(2)8-15(3)11-18/h5-11H,12H2,1-4H3,(H,20,23)
InChIKeyOQHZYPRYKQIHFA-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.60
Rot. Bonds4

About 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide

2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide (PubChem CID 113168520) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide
PubChem CID113168520
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cccc(C)c1)c1cc(C)cc(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-6-5-7-17(9-13)20-19(23)12-21(16(4)22)18-10-14(2)8-15(3)11-18/h5-11H,12H2,1-4H3,(H,20,23)
InChIKeyOQHZYPRYKQIHFA-UHFFFAOYSA-N
XLogP3.60
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetylanilino)-N-(3-methylphenyl)acetamide
CID 113167157
2-(N-acetyl-3-methylanilino)-N-(3-chlorophenyl)acetamide
CID 113167570
2-(N-acetyl-3-chloroanilino)-N-(3-methylphenyl)acetamide
CID 113171372
2-(N-acetyl-3,5-dimethylanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113168527
2-(N-acetyl-3-methylanilino)-N-(4-bromophenyl)acetamide
CID 113167580
2-(N-acetyl-3-methylanilino)-N-(3-methoxyphenyl)acetamide
CID 113167583
2-(N-acetyl-2,6-difluoroanilino)-N-(3-methylphenyl)acetamide
CID 113181456
2-(N-acetyl-3,5-dimethylanilino)-N-(4-chlorophenyl)acetamide
CID 113168546
2-(N-acetyl-3,5-dimethylanilino)-N-(4-acetylphenyl)acetamide
CID 113168572
2-(N-acetyl-3,5-dimethylanilino)-N-[4-(diethylamino)phenyl]acetamide
CID 113168581
2-(N-acetyl-4-chloro-2-methylanilino)-N-(3-methylphenyl)acetamide
CID 113172074
2-(N-acetyl-3,5-dimethylanilino)-N-(2-bromophenyl)acetamide
CID 113168590

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide (CID 113168520) is 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide is CC(=O)N(CC(=O)Nc1cccc(C)c1)c1cc(C)cc(C)c1.
What is the InChIKey of 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide?
The InChIKey is OQHZYPRYKQIHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-6-5-7-17(9-13)20-19(23)12-21(16(4)22)18-10-14(2)8-15(3)11-18/h5-11H,12H2,1-4H3,(H,20,23).
What are the key properties of 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide?
2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide has a molecular weight of 310.40 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 113168520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).