5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one

C14H22N4O4 — CID 14053773

IUPAC5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C1CCC(C(=O)N2CCN(C(=O)N3CCOCC3)CC2)N1
InChIInChI=1S/C14H22N4O4/c19-12-2-1-11(15-12)13(20)16-3-5-17(6-4-16)14(21)18-7-9-22-10-8-18/h11H,1-10H2,(H,15,19)
InChIKeyXFZINNVXBANDML-UHFFFAOYSA-N
MW310.35 g/mol
LogP-1.14
Rot. Bonds1

About 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one

5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one (PubChem CID 14053773) has the molecular formula C14H22N4O4 and a molecular weight of 310.35 g/mol. Its IUPAC name is 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one
PubChem CID14053773
Molecular FormulaC14H22N4O4
Molecular Weight310.35 g/mol
Exact Mass310.16
IUPAC Name5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C1CCC(C(=O)N2CCN(C(=O)N3CCOCC3)CC2)N1
InChIInChI=1S/C14H22N4O4/c19-12-2-1-11(15-12)13(20)16-3-5-17(6-4-16)14(21)18-7-9-22-10-8-18/h11H,1-10H2,(H,15,19)
InChIKeyXFZINNVXBANDML-UHFFFAOYSA-N
XLogP-1.14
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 5-1.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one (CID 14053773) is 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one is O=C1CCC(C(=O)N2CCN(C(=O)N3CCOCC3)CC2)N1.
What is the InChIKey of 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is XFZINNVXBANDML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O4/c19-12-2-1-11(15-12)13(20)16-3-5-17(6-4-16)14(21)18-7-9-22-10-8-18/h11H,1-10H2,(H,15,19).
What are the key properties of 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one?
5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 310.35 g/mol, XLogP of -1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 14053773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).