[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate

C18H16ClNO5 — CID 8732581

IUPAC[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate
SMILESO=C(COc1ccc(Cl)c2ccccc12)OCC(=O)N1CCCC1=O
InChIInChI=1S/C18H16ClNO5/c19-14-7-8-15(13-5-2-1-4-12(13)14)24-11-18(23)25-10-17(22)20-9-3-6-16(20)21/h1-2,4-5,7-8H,3,6,9-11H2
InChIKeyDLQUONIERHAMRI-UHFFFAOYSA-N
MW361.78 g/mol
LogP2.56
Rot. Bonds5

About [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate

[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate (PubChem CID 8732581) has the molecular formula C18H16ClNO5 and a molecular weight of 361.78 g/mol. Its IUPAC name is [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate.

Molecular Properties

Compound Name[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate
PubChem CID8732581
Molecular FormulaC18H16ClNO5
Molecular Weight361.78 g/mol
Exact Mass361.07
IUPAC Name[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate
SMILESO=C(COc1ccc(Cl)c2ccccc12)OCC(=O)N1CCCC1=O
InChIInChI=1S/C18H16ClNO5/c19-14-7-8-15(13-5-2-1-4-12(13)14)24-11-18(23)25-10-17(22)20-9-3-6-16(20)21/h1-2,4-5,7-8H,3,6,9-11H2
InChIKeyDLQUONIERHAMRI-UHFFFAOYSA-N
XLogP2.56
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.78
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(3R)-3-methylpiperidin-1-yl]-2-oxoethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate
CID 8732428
2-(4-chloronaphthalen-1-yl)oxy-1-pyrrolidin-1-ylethanone
CID 112779040
phenacyl 2-(4-chloronaphthalen-1-yl)oxyacetate
CID 8732424
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 3,6-dichloropyridine-2-carboxylate
CID 2633537
[2-(cyclopropylamino)-2-oxoethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate
CID 8732373
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(2-chlorophenoxy)acetate
CID 8908985
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(1H-indol-3-yl)acetate
CID 7664769
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-[(3,4-dichlorobenzoyl)amino]acetate
CID 2394384
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] anthracene-9-carboxylate
CID 3662156
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 3-amino-4-chlorobenzoate
CID 2630465
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 4-(1,3-dioxoisoindol-2-yl)butanoate
CID 9363133
2-(4-chloronaphthalen-1-yl)oxyacetate
CID 6995020

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate?
The IUPAC name of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate (CID 8732581) is [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate.
What is the SMILES notation for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate?
The canonical SMILES for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate is O=C(COc1ccc(Cl)c2ccccc12)OCC(=O)N1CCCC1=O.
What is the InChIKey of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate?
The InChIKey is DLQUONIERHAMRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClNO5/c19-14-7-8-15(13-5-2-1-4-12(13)14)24-11-18(23)25-10-17(22)20-9-3-6-16(20)21/h1-2,4-5,7-8H,3,6,9-11H2.
What are the key properties of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate?
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate has a molecular weight of 361.78 g/mol, XLogP of 2.56, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 2-(4-chloronaphthalen-1-yl)oxyacetate is sourced from PubChem (CID 8732581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).