2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide

C16H15Cl2NO2 — CID 9495803

IUPAC2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-21-14-4-2-3-11(7-14)10-19-16(20)8-12-5-6-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeySOBRHPWEQDZCCS-UHFFFAOYSA-N
MW324.21 g/mol
LogP3.86
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide

2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide (PubChem CID 9495803) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide
PubChem CID9495803
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-21-14-4-2-3-11(7-14)10-19-16(20)8-12-5-6-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeySOBRHPWEQDZCCS-UHFFFAOYSA-N
XLogP3.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 63311270
2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 33100291
5-chloro-2-fluoro-N-[(3-methoxyphenyl)methyl]benzamide
CID 9088202
2-chloro-N-[(3-methoxyphenyl)methyl]acetamide
CID 4839545
3-chloro-N-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]benzamide
CID 27231758
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 47292082
4-chloro-N-[3-[(3-methoxyphenyl)methylamino]-3-oxopropyl]benzamide
CID 9495839
1-[(2-chlorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]urea
CID 38157251
1-[(2,4-dichlorophenyl)methyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 53284653
2-(4-chlorophenyl)sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide
CID 18074647
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide (CID 9495803) is 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide is COc1cccc(CNC(=O)Cc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The InChIKey is SOBRHPWEQDZCCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-21-14-4-2-3-11(7-14)10-19-16(20)8-12-5-6-13(17)9-15(12)18/h2-7,9H,8,10H2,1H3,(H,19,20).
What are the key properties of 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide?
2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide has a molecular weight of 324.21 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 9495803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).