N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide

C15H14ClNO3 — CID 838230

IUPACN-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2)cc1Cl
InChIInChI=1S/C15H14ClNO3/c1-19-14-8-7-11(9-13(14)16)17-15(18)10-20-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJGPSDQIGZRXNDV-UHFFFAOYSA-N
MW291.73 g/mol
LogP3.37
Rot. Bonds5

About N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide

N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide (PubChem CID 838230) has the molecular formula C15H14ClNO3 and a molecular weight of 291.73 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide
PubChem CID838230
Molecular FormulaC15H14ClNO3
Molecular Weight291.73 g/mol
Exact Mass291.07
IUPAC NameN-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2)cc1Cl
InChIInChI=1S/C15H14ClNO3/c1-19-14-8-7-11(9-13(14)16)17-15(18)10-20-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJGPSDQIGZRXNDV-UHFFFAOYSA-N
XLogP3.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.73
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Acetamide, N-(3-chloro-4-methoxyphenyl)-
CID 23474
6-Chloro-2H-1,4-benzoxazin-3(4H)-one
CID 309259
Phenoxyacetanilide
CID 264248
Carbamic acid, (3-chloro-4-methoxyphenyl)-, 1-methylethyl ester
CID 94705
Zinc00711147
CID 1039828
2H-1,4-Benzoxazin-3(4H)-one, 6-chloro-2-methyl-
CID 22035
N-(2-chlorophenyl)-2-phenoxyacetamide
CID 309534
4-(2,4-dichlorophenoxy)-N-phenylbutanamide
CID 2169139
N-(4-(2,4-Dichlorophenoxy)phenyl)acetamide
CID 3017018
N-(3-chloro-4-ethoxyphenyl)acetamide
CID 13799749
N-(4-chlorophenyl)-2-phenoxypropanamide
CID 3140491
N-(2,5-dichlorophenyl)-2-phenoxyacetamide
CID 795718

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide (CID 838230) is N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide is COc1ccc(NC(=O)COc2ccccc2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide?
The InChIKey is JGPSDQIGZRXNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3/c1-19-14-8-7-11(9-13(14)16)17-15(18)10-20-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide?
N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide has a molecular weight of 291.73 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-2-phenoxyacetamide is sourced from PubChem (CID 838230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).