N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide

C16H16ClNO3 — CID 78804409

IUPACN-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H16ClNO3/c1-20-14-7-8-15(21-2)11(9-14)10-16(19)18-13-5-3-12(17)4-6-13/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyMCUHXKALXZSNNU-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.54
Rot. Bonds5

About N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide

N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide (PubChem CID 78804409) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide
PubChem CID78804409
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H16ClNO3/c1-20-14-7-8-15(21-2)11(9-14)10-16(19)18-13-5-3-12(17)4-6-13/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyMCUHXKALXZSNNU-UHFFFAOYSA-N
XLogP3.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethoxyphenyl)-N-(3,4-dimethylphenyl)acetamide
CID 78804402
2-(5-chloro-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 17423898
2-(2,5-dimethoxyphenyl)-N-naphthalen-2-ylacetamide
CID 78804408
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 92670451
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 78804386
N-[1-(4-chlorophenyl)ethyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 43874167
2-(2,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 78804056
[2-(4-methoxyanilino)-2-oxoethyl] 2-(5-chloro-2-methoxyphenyl)acetate
CID 8615173
2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 15907736
2-(2,5-dimethoxyphenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 7581668
2-(2,5-dimethoxyphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 78807074
N-(4-chlorophenyl)-2-(4-methoxy-3-methylphenyl)acetamide
CID 16848482

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide (CID 78804409) is N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide is COc1ccc(OC)c(CC(=O)Nc2ccc(Cl)cc2)c1.
What is the InChIKey of N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is MCUHXKALXZSNNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-14-7-8-15(21-2)11(9-14)10-16(19)18-13-5-3-12(17)4-6-13/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide?
N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 305.76 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 78804409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).