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

C18H19Cl2NO4 — CID 54785534

IUPACN-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide
SMILESCOc1cc(Cl)c(CNC(=O)COc2ccc(Cl)cc2C)cc1OC
InChIInChI=1S/C18H19Cl2NO4/c1-11-6-13(19)4-5-15(11)25-10-18(22)21-9-12-7-16(23-2)17(24-3)8-14(12)20/h4-8H,9-10H2,1-3H3,(H,21,22)
InChIKeyYDJHLGXCKHFPPP-UHFFFAOYSA-N
MW384.26 g/mol
LogP4.01
Rot. Bonds7

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

N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide (PubChem CID 54785534) has the molecular formula C18H19Cl2NO4 and a molecular weight of 384.26 g/mol. Its IUPAC name is N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide
PubChem CID54785534
Molecular FormulaC18H19Cl2NO4
Molecular Weight384.26 g/mol
Exact Mass383.07
IUPAC NameN-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide
SMILESCOc1cc(Cl)c(CNC(=O)COc2ccc(Cl)cc2C)cc1OC
InChIInChI=1S/C18H19Cl2NO4/c1-11-6-13(19)4-5-15(11)25-10-18(22)21-9-12-7-16(23-2)17(24-3)8-14(12)20/h4-8H,9-10H2,1-3H3,(H,21,22)
InChIKeyYDJHLGXCKHFPPP-UHFFFAOYSA-N
XLogP4.01
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.26
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 33099359
2-(4-chloro-2-methylphenoxy)-N-(2-methoxyethyl)acetamide
CID 2276597
2-(4-chloro-2-methylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 2545386
2-(4-chloro-2-methylphenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 3624933
N-[2-(4-chloro-2-methylphenoxy)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 113102607
2-(4-chloro-2-methylphenoxy)-N-[2-(methylamino)ethyl]acetamide
CID 119499872
N-[(2-chloro-4-methoxyphenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 110783322
N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(3-ethylphenoxy)acetamide
CID 54785354
2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-(2,5-dichlorophenyl)acetamide
CID 7936907
2-(4-chloro-2-methylphenoxy)-N-(methylcarbamoyl)acetamide
CID 4805018
[[2-(4-chloro-2-methylphenoxy)acetyl]amino] acetate
CID 154313785
N'-[2-(4-chloro-2-methylphenoxy)acetyl]butanehydrazide
CID 3250924

Frequently Asked Questions

What is the IUPAC name of N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide?
The IUPAC name of N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide (CID 54785534) is N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide.
What is the SMILES notation for N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide?
The canonical SMILES for N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide is COc1cc(Cl)c(CNC(=O)COc2ccc(Cl)cc2C)cc1OC.
What is the InChIKey of N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide?
The InChIKey is YDJHLGXCKHFPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO4/c1-11-6-13(19)4-5-15(11)25-10-18(22)21-9-12-7-16(23-2)17(24-3)8-14(12)20/h4-8H,9-10H2,1-3H3,(H,21,22).
What are the key properties of N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide?
N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide has a molecular weight of 384.26 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-2-(4-chloro-2-methylphenoxy)acetamide is sourced from PubChem (CID 54785534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).