[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate

C18H26N2O6 — CID 4789295

IUPAC[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate
SMILESO=C(CC1(C(=O)OCC(=O)N2CCCC2=O)CCCC1)N1CCOCC1
InChIInChI=1S/C18H26N2O6/c21-14-4-3-7-20(14)16(23)13-26-17(24)18(5-1-2-6-18)12-15(22)19-8-10-25-11-9-19/h1-13H2
InChIKeyVOTNVFOZJRCYRY-UHFFFAOYSA-N
MW366.41 g/mol
LogP0.49
Rot. Bonds5

About [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate

[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate (PubChem CID 4789295) has the molecular formula C18H26N2O6 and a molecular weight of 366.41 g/mol. Its IUPAC name is [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Name[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate
PubChem CID4789295
Molecular FormulaC18H26N2O6
Molecular Weight366.41 g/mol
Exact Mass366.18
IUPAC Name[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate
SMILESO=C(CC1(C(=O)OCC(=O)N2CCCC2=O)CCCC1)N1CCOCC1
InChIInChI=1S/C18H26N2O6/c21-14-4-3-7-20(14)16(23)13-26-17(24)18(5-1-2-6-18)12-15(22)19-8-10-25-11-9-19/h1-13H2
InChIKeyVOTNVFOZJRCYRY-UHFFFAOYSA-N
XLogP0.49
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate?
The IUPAC name of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate (CID 4789295) is [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate.
What is the SMILES notation for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate?
The canonical SMILES for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate is O=C(CC1(C(=O)OCC(=O)N2CCCC2=O)CCCC1)N1CCOCC1.
What is the InChIKey of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate?
The InChIKey is VOTNVFOZJRCYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O6/c21-14-4-3-7-20(14)16(23)13-26-17(24)18(5-1-2-6-18)12-15(22)19-8-10-25-11-9-19/h1-13H2.
What are the key properties of [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate?
[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate has a molecular weight of 366.41 g/mol, XLogP of 0.49, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 4789295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).