N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide

C17H17ClN2O3 — CID 110778435

IUPACN-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(Cl)c2)cc1NC(C)=O
InChIInChI=1S/C17H17ClN2O3/c1-11(21)19-15-10-14(6-7-16(15)23-2)20-17(22)9-12-4-3-5-13(18)8-12/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDWAOEQBPPNVFES-UHFFFAOYSA-N
MW332.79 g/mol
LogP3.49
Rot. Bonds5

About N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide

N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide (PubChem CID 110778435) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide
PubChem CID110778435
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC NameN-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(Cl)c2)cc1NC(C)=O
InChIInChI=1S/C17H17ClN2O3/c1-11(21)19-15-10-14(6-7-16(15)23-2)20-17(22)9-12-4-3-5-13(18)8-12/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDWAOEQBPPNVFES-UHFFFAOYSA-N
XLogP3.49
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamido-4-methoxyphenyl)-3-phenylpropanamide
CID 51651956
N-(5-acetamido-2-methoxyphenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-oxo-1H-pyrimidin-4-yl]acetamide
CID 136616061
N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
CID 35348603
methyl 3-[[2-(3-chlorophenyl)acetyl]amino]benzoate
CID 62505130
N-(5-acetamido-2-methoxyphenyl)-2-(4-methylphenyl)acetamide
CID 17432370
3-fluoro-N-[5-[[2-(3-fluorophenyl)acetyl]amino]-2-methoxyphenyl]benzamide
CID 55725735
2-(3-chlorophenyl)-N-[2-methoxy-5-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 110668062
N-(5-acetamido-2-methoxyphenyl)-2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]acetamide
CID 8599537
2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide
CID 28712195
N-(3,4-dimethoxyphenyl)-2-(3-methylphenyl)acetamide
CID 9497409
N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 49159062
N-(5-acetamido-2-methoxyphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 8578537

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide?
The IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide (CID 110778435) is N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide.
What is the SMILES notation for N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide?
The canonical SMILES for N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide is COc1ccc(NC(=O)Cc2cccc(Cl)c2)cc1NC(C)=O.
What is the InChIKey of N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide?
The InChIKey is DWAOEQBPPNVFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-11(21)19-15-10-14(6-7-16(15)23-2)20-17(22)9-12-4-3-5-13(18)8-12/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide?
N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide has a molecular weight of 332.79 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide is sourced from PubChem (CID 110778435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).