2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide

C18H19ClN2O2 — CID 113171908

IUPAC2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(C)cc1)c1cc(Cl)ccc1C
InChIInChI=1S/C18H19ClN2O2/c1-12-4-8-16(9-5-12)20-18(23)11-21(14(3)22)17-10-15(19)7-6-13(17)2/h4-10H,11H2,1-3H3,(H,20,23)
InChIKeyUUBHELVLDGHMPO-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.95
Rot. Bonds4

About 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide

2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide (PubChem CID 113171908) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide
PubChem CID113171908
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC Name2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(C)cc1)c1cc(Cl)ccc1C
InChIInChI=1S/C18H19ClN2O2/c1-12-4-8-16(9-5-12)20-18(23)11-21(14(3)22)17-10-15(19)7-6-13(17)2/h4-10H,11H2,1-3H3,(H,20,23)
InChIKeyUUBHELVLDGHMPO-UHFFFAOYSA-N
XLogP3.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,5-dimethylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113168161
2-(N-acetyl-2,5-dimethylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113168163
ethyl 4-[[2-(N-acetyl-5-chloro-2-methylanilino)acetyl]amino]benzoate
CID 113171974
2-(N-acetyl-2,5-dimethylanilino)-N-phenylacetamide
CID 113168130
2-(N-acetyl-5-chloro-2-methylanilino)-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 113171939
2-(N-acetyl-4-chloro-2-methylanilino)-N-(3-methylphenyl)acetamide
CID 113172074
N-(4-acetamidophenyl)-3-(N-acetyl-5-chloro-2-methylanilino)propanamide
CID 113127781
2-(N-acetyl-5-chloro-2-methylanilino)-N-(3-methoxyphenyl)acetamide
CID 113171944
2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-(4-methylphenyl)acetamide
CID 1204044
2-(N-acetyl-2,4,6-trimethylanilino)-N-(4-methylphenyl)acetamide
CID 113170003
2-(N-acetyl-2,5-dimethylanilino)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
CID 113168215
2-(N-acetyl-4-chloro-2-methylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113172103

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide (CID 113171908) is 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(C)cc1)c1cc(Cl)ccc1C.
What is the InChIKey of 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide?
The InChIKey is UUBHELVLDGHMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-12-4-8-16(9-5-12)20-18(23)11-21(14(3)22)17-10-15(19)7-6-13(17)2/h4-10H,11H2,1-3H3,(H,20,23).
What are the key properties of 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide?
2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide has a molecular weight of 330.82 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 113171908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).