(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate

C15H16Cl2N2O4 — CID 9113795

IUPAC(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccc(Cl)cc1Cl)OCC(=O)N1CCCC1
InChIInChI=1S/C15H16Cl2N2O4/c16-10-3-4-11(12(17)7-10)15(22)18-8-14(21)23-9-13(20)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8-9H2,(H,18,22)
InChIKeyJUEGCCREUWCDBU-UHFFFAOYSA-N
MW359.21 g/mol
LogP1.89
Rot. Bonds5

About (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate

(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate (PubChem CID 9113795) has the molecular formula C15H16Cl2N2O4 and a molecular weight of 359.21 g/mol. Its IUPAC name is (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate.

Molecular Properties

Compound Name(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate
PubChem CID9113795
Molecular FormulaC15H16Cl2N2O4
Molecular Weight359.21 g/mol
Exact Mass358.05
IUPAC Name(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccc(Cl)cc1Cl)OCC(=O)N1CCCC1
InChIInChI=1S/C15H16Cl2N2O4/c16-10-3-4-11(12(17)7-10)15(22)18-8-14(21)23-9-13(20)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8-9H2,(H,18,22)
InChIKeyJUEGCCREUWCDBU-UHFFFAOYSA-N
XLogP1.89
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.21
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate with MolForge

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Related Compounds

[2-(Ethylamino)-2-oxoethyl] 3-[(4-chlorobenzoyl)amino]propanoate
CID 2571604
N-(2,4-Dichlorobenzoyl)glycine
CID 731352
Glycine, N-(2-chlorobenzoyl)-, methyl ester
CID 531380
2,4-dichloro-N-[3-(morpholin-4-yl)propyl]benzamide
CID 2165284
[2-(Cyclopentylamino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]acetate
CID 2407437
(2-Oxooxolan-3-yl) 2-[(2-chlorobenzoyl)amino]acetate
CID 3908649
[2-(Cycloheptylamino)-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]acetate
CID 4782978
[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate
CID 16240695
Benzamide, 2,4-dichloro-N-(2-(4-morpholinyl)ethyl)-
CID 2170880
2,4-dichloro-N-[2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-oxoethyl]benzamide
CID 4791906
(2-Amino-2-oxoethyl) 2-[(4-chlorobenzoyl)amino]acetate
CID 2118289
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]acetate
CID 2435045

Frequently Asked Questions

What is the IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate?
The IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate (CID 9113795) is (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate.
What is the SMILES notation for (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate?
The canonical SMILES for (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate is O=C(CNC(=O)c1ccc(Cl)cc1Cl)OCC(=O)N1CCCC1.
What is the InChIKey of (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate?
The InChIKey is JUEGCCREUWCDBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O4/c16-10-3-4-11(12(17)7-10)15(22)18-8-14(21)23-9-13(20)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8-9H2,(H,18,22).
What are the key properties of (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate?
(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate has a molecular weight of 359.21 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2,4-dichlorobenzoyl)amino]acetate is sourced from PubChem (CID 9113795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).