N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide

C15H26N4O4 — CID 119890268

IUPACN-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide
SMILESO=C(NC1CC(=O)N(CCN2CCOCC2)C1)C1COCCN1
InChIInChI=1S/C15H26N4O4/c20-14-9-12(17-15(21)13-11-23-6-1-16-13)10-19(14)3-2-18-4-7-22-8-5-18/h12-13,16H,1-11H2,(H,17,21)
InChIKeyNGSNXZYAJZEKFD-UHFFFAOYSA-N
MW326.40 g/mol
LogP-1.98
Rot. Bonds5

About N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide

N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide (PubChem CID 119890268) has the molecular formula C15H26N4O4 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide
PubChem CID119890268
Molecular FormulaC15H26N4O4
Molecular Weight326.40 g/mol
Exact Mass326.20
IUPAC NameN-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide
SMILESO=C(NC1CC(=O)N(CCN2CCOCC2)C1)C1COCCN1
InChIInChI=1S/C15H26N4O4/c20-14-9-12(17-15(21)13-11-23-6-1-16-13)10-19(14)3-2-18-4-7-22-8-5-18/h12-13,16H,1-11H2,(H,17,21)
InChIKeyNGSNXZYAJZEKFD-UHFFFAOYSA-N
XLogP-1.98
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 5-1.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide?
The IUPAC name of N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide (CID 119890268) is N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide.
What is the SMILES notation for N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide?
The canonical SMILES for N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide is O=C(NC1CC(=O)N(CCN2CCOCC2)C1)C1COCCN1.
What is the InChIKey of N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide?
The InChIKey is NGSNXZYAJZEKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O4/c20-14-9-12(17-15(21)13-11-23-6-1-16-13)10-19(14)3-2-18-4-7-22-8-5-18/h12-13,16H,1-11H2,(H,17,21).
What are the key properties of N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide?
N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of -1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-morpholin-4-ylethyl)-5-oxopyrrolidin-3-yl]morpholine-3-carboxamide is sourced from PubChem (CID 119890268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).