2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide

C17H17Cl2NO3 — CID 33100291

IUPAC2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(OC)c(CNC(=O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C17H17Cl2NO3/c1-22-14-5-6-16(23-2)12(7-14)10-20-17(21)8-11-3-4-13(18)9-15(11)19/h3-7,9H,8,10H2,1-2H3,(H,20,21)
InChIKeyBWXBBOLBQDHWOX-UHFFFAOYSA-N
MW354.23 g/mol
LogP3.87
Rot. Bonds6

About 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide

2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide (PubChem CID 33100291) has the molecular formula C17H17Cl2NO3 and a molecular weight of 354.23 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
PubChem CID33100291
Molecular FormulaC17H17Cl2NO3
Molecular Weight354.23 g/mol
Exact Mass353.06
IUPAC Name2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(OC)c(CNC(=O)Cc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C17H17Cl2NO3/c1-22-14-5-6-16(23-2)12(7-14)10-20-17(21)8-11-3-4-13(18)9-15(11)19/h3-7,9H,8,10H2,1-2H3,(H,20,21)
InChIKeyBWXBBOLBQDHWOX-UHFFFAOYSA-N
XLogP3.87
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.23
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 33099359
2-(3-chlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 110779915
[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 2,5-dimethoxybenzoate
CID 7486908
2-(2,4-dichlorophenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 2709356
2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495803
N-[(2,4-dichlorophenyl)methyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9045958
N-[(2,4-dichlorophenyl)methyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 2707238
1-N,4-N-bis[(2,5-dimethoxyphenyl)methyl]benzene-1,4-dicarboxamide
CID 46542093
N-[(2,4-dichlorophenyl)methyl]-2,3,4-trimethoxybenzamide
CID 55329564
3-chloro-N-[(5-chloro-2-methoxyphenyl)methyl]propanamide
CID 82110952
N-[(2,4-dichlorophenyl)methyl]-2-(2,4-dimethoxy-N-methylsulfonylanilino)acetamide
CID 51342745
N-[(2,4-dichlorophenyl)methyl]-2-(3,5-dimethoxyphenoxy)acetamide
CID 7713902

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide (CID 33100291) is 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide is COc1ccc(OC)c(CNC(=O)Cc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide?
The InChIKey is BWXBBOLBQDHWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2NO3/c1-22-14-5-6-16(23-2)12(7-14)10-20-17(21)8-11-3-4-13(18)9-15(11)19/h3-7,9H,8,10H2,1-2H3,(H,20,21).
What are the key properties of 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide?
2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide has a molecular weight of 354.23 g/mol, XLogP of 3.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 33100291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).