2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide

C18H18ClNO3 — CID 30843617

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)Nc1cc(Cl)ccc1C
InChIInChI=1S/C18H18ClNO3/c1-11-4-6-15(19)10-16(11)20-18(22)9-14-8-13(12(2)21)5-7-17(14)23-3/h4-8,10H,9H2,1-3H3,(H,20,22)
InChIKeyQXDXVJFMKCORCO-UHFFFAOYSA-N
MW331.80 g/mol
LogP4.04
Rot. Bonds5

About 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide

2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide (PubChem CID 30843617) has the molecular formula C18H18ClNO3 and a molecular weight of 331.80 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide
PubChem CID30843617
Molecular FormulaC18H18ClNO3
Molecular Weight331.80 g/mol
Exact Mass331.10
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)Nc1cc(Cl)ccc1C
InChIInChI=1S/C18H18ClNO3/c1-11-4-6-15(19)10-16(11)20-18(22)9-14-8-13(12(2)21)5-7-17(14)23-3/h4-8,10H,9H2,1-3H3,(H,20,22)
InChIKeyQXDXVJFMKCORCO-UHFFFAOYSA-N
XLogP4.04
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.80
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dichlorophenyl)acetamide
CID 30845420
[2-(4-chloro-2-methylanilino)-2-oxoethyl] 2-(5-acetyl-2-methoxyphenyl)acetate
CID 8534424
2-(5-acetyl-2-methoxyphenyl)-N-(4-bromo-2-chlorophenyl)acetamide
CID 30847759
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dimethoxyphenyl)acetamide
CID 16557440
(5-chloro-2-methoxyphenyl)methyl-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-methylazanium
CID 9136454
2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide
CID 17427408
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide
CID 43024655
1-[4-[(2S)-3-(5-chloro-2-methylanilino)-2-hydroxypropoxy]-3-methoxyphenyl]ethanone
CID 8741288
2-(5-acetyl-2-methoxyphenyl)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]acetamide
CID 30867221
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
2-(5-acetyl-2-methoxyphenyl)-N-(3-aminopropyl)acetamide
CID 119404836
2-(5-chloro-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 17423898

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide (CID 30843617) is 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide is COc1ccc(C(C)=O)cc1CC(=O)Nc1cc(Cl)ccc1C.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide?
The InChIKey is QXDXVJFMKCORCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClNO3/c1-11-4-6-15(19)10-16(11)20-18(22)9-14-8-13(12(2)21)5-7-17(14)23-3/h4-8,10H,9H2,1-3H3,(H,20,22).
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide?
2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide has a molecular weight of 331.80 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 30843617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).