2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide

C17H16ClNO4 — CID 41021404

IUPAC2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc(Cl)cc2C(C)=O)c1
InChIInChI=1S/C17H16ClNO4/c1-11(20)15-8-12(18)6-7-16(15)23-10-17(21)19-13-4-3-5-14(9-13)22-2/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyULACZKFGUZFJCV-UHFFFAOYSA-N
MW333.77 g/mol
LogP3.57
Rot. Bonds6

About 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide

2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide (PubChem CID 41021404) has the molecular formula C17H16ClNO4 and a molecular weight of 333.77 g/mol. Its IUPAC name is 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide
PubChem CID41021404
Molecular FormulaC17H16ClNO4
Molecular Weight333.77 g/mol
Exact Mass333.08
IUPAC Name2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc(Cl)cc2C(C)=O)c1
InChIInChI=1S/C17H16ClNO4/c1-11(20)15-8-12(18)6-7-16(15)23-10-17(21)19-13-4-3-5-14(9-13)22-2/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyULACZKFGUZFJCV-UHFFFAOYSA-N
XLogP3.57
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.77
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 7859310
2-(2-acetyl-4-chlorophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7167750
5-chloro-2-[2-(3-methylanilino)-2-oxoethoxy]benzoic acid
CID 8707257
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
2-(3-chloro-4-fluorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 7751222
5-chloro-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-methoxybenzamide
CID 39045106
2-(4-bromo-2-fluorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 7500246
2-(2-bromophenoxy)-N-(3-methoxyphenyl)acetamide
CID 729437
N-[3-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]phenyl]propanamide
CID 18870278
methyl 6-chloro-4-[2-(3-methoxyanilino)-2-oxoethoxy]quinoline-2-carboxylate
CID 53113143
2-(4-chloro-2-morpholin-4-ylsulfonylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 30147094
2,5-dimethoxy-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]benzamide
CID 55886827

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide (CID 41021404) is 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2ccc(Cl)cc2C(C)=O)c1.
What is the InChIKey of 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide?
The InChIKey is ULACZKFGUZFJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClNO4/c1-11(20)15-8-12(18)6-7-16(15)23-10-17(21)19-13-4-3-5-14(9-13)22-2/h3-9H,10H2,1-2H3,(H,19,21).
What are the key properties of 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide?
2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide has a molecular weight of 333.77 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 41021404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).