N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide

C16H16ClNO3 — CID 3749925

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide
SMILESCOc1cc(OC)c(NC(=O)Cc2ccccc2)cc1Cl
InChIInChI=1S/C16H16ClNO3/c1-20-14-10-15(21-2)13(9-12(14)17)18-16(19)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,18,19)
InChIKeyJBHWGIOLSYSUSP-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.54
Rot. Bonds5

About N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide

N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide (PubChem CID 3749925) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide
PubChem CID3749925
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide
SMILESCOc1cc(OC)c(NC(=O)Cc2ccccc2)cc1Cl
InChIInChI=1S/C16H16ClNO3/c1-20-14-10-15(21-2)13(9-12(14)17)18-16(19)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,18,19)
InChIKeyJBHWGIOLSYSUSP-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

N-(5-chloro-2,4-dihydroxyphenyl)-1-phenylcyclobutane-1-carboxamide
CID 72203382
N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
CID 2897418
Butanamide, N-(5-chloro-2,4-dimethoxyphenyl)-3-oxo-
CID 85565
N-(5-Chloro-2,4-dimethoxyphenyl)-2-fluorobenzamide
CID 836294
N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylbutanamide
CID 2922753
N-(5-Chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
CID 868614
4-(5-Chloro-2,4-dimethoxyanilino)naphthalene-1,2-dione
CID 671256
N-(5-chloro-2,4-dimethoxyphenyl)-3-fluorobenzamide
CID 835624
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-methylphenoxy)acetamide
CID 836312
N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide
CID 1040166
2-(2-chloro-6-fluorophenyl)-N-(5-chloro-2-methoxyphenyl)acetamide
CID 2081745
N-(3-chloro-4-methoxyphenyl)-2-methoxy-2-phenylacetamide
CID 2898567

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide (CID 3749925) is N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide is COc1cc(OC)c(NC(=O)Cc2ccccc2)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide?
The InChIKey is JBHWGIOLSYSUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-14-10-15(21-2)13(9-12(14)17)18-16(19)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,18,19).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide?
N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide 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-(5-chloro-2,4-dimethoxyphenyl)-2-phenylacetamide is sourced from PubChem (CID 3749925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).