(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate

C18H17Cl2NO4 — CID 9270866

IUPAC(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate
SMILESCCOc1ccccc1COC(=O)CNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H17Cl2NO4/c1-2-24-16-6-4-3-5-12(16)11-25-17(22)10-21-18(23)14-8-7-13(19)9-15(14)20/h3-9H,2,10-11H2,1H3,(H,21,23)
InChIKeyNHJQOSLZRLKRKE-UHFFFAOYSA-N
MW382.24 g/mol
LogP3.87
Rot. Bonds7

About (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate

(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate (PubChem CID 9270866) has the molecular formula C18H17Cl2NO4 and a molecular weight of 382.24 g/mol. Its IUPAC name is (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate.

Molecular Properties

Compound Name(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate
PubChem CID9270866
Molecular FormulaC18H17Cl2NO4
Molecular Weight382.24 g/mol
Exact Mass381.05
IUPAC Name(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate
SMILESCCOc1ccccc1COC(=O)CNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H17Cl2NO4/c1-2-24-16-6-4-3-5-12(16)11-25-17(22)10-21-18(23)14-8-7-13(19)9-15(14)20/h3-9H,2,10-11H2,1H3,(H,21,23)
InChIKeyNHJQOSLZRLKRKE-UHFFFAOYSA-N
XLogP3.87
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.24
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chlorophenyl)methyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 7951719
(4-chlorophenyl)methyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 7807819
2-(4-ethoxyphenoxy)ethyl 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 7843780
(2-methylphenyl)methyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 7807817
[2-(trifluoromethyl)phenyl]methyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 7807869
2-phenoxyethyl 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 7843771
(2-ethoxyphenyl)methyl 2-[(4-methoxybenzoyl)amino]acetate
CID 8788915
[2-(4-ethoxyphenyl)-2-oxoethyl] 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 9270722
2-oxopropyl 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 7843867
4-chloro-N-[(2-ethoxyphenyl)methyl]-2-fluorobenzamide
CID 94472484
[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 30046828
(5-acetyl-2-ethoxyphenyl)methyl 2-[(4-chlorobenzoyl)amino]acetate
CID 7878744

Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate?
The IUPAC name of (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate (CID 9270866) is (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate.
What is the SMILES notation for (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate?
The canonical SMILES for (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate is CCOc1ccccc1COC(=O)CNC(=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate?
The InChIKey is NHJQOSLZRLKRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2NO4/c1-2-24-16-6-4-3-5-12(16)11-25-17(22)10-21-18(23)14-8-7-13(19)9-15(14)20/h3-9H,2,10-11H2,1H3,(H,21,23).
What are the key properties of (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate?
(2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate has a molecular weight of 382.24 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate is sourced from PubChem (CID 9270866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).