3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one

C17H19N5O3 — CID 56800022

IUPAC3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
SMILESO=C(c1cnc2ccccn2c1=O)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C17H19N5O3/c23-15(13-10-19-14-5-1-2-8-22(14)16(13)24)20-7-3-4-12(11-20)21-9-6-18-17(21)25/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,18,25)
InChIKeyLEZNWIZRHLJUJN-UHFFFAOYSA-N
MW341.37 g/mol
LogP0.32
Rot. Bonds2

About 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one

3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one (PubChem CID 56800022) has the molecular formula C17H19N5O3 and a molecular weight of 341.37 g/mol. Its IUPAC name is 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
PubChem CID56800022
Molecular FormulaC17H19N5O3
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC Name3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
SMILESO=C(c1cnc2ccccn2c1=O)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C17H19N5O3/c23-15(13-10-19-14-5-1-2-8-22(14)16(13)24)20-7-3-4-12(11-20)21-9-6-18-17(21)25/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,18,25)
InChIKeyLEZNWIZRHLJUJN-UHFFFAOYSA-N
XLogP0.32
TPSA87.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one (CID 56800022) is 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one is O=C(c1cnc2ccccn2c1=O)N1CCCC(N2CCNC2=O)C1.
What is the InChIKey of 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is LEZNWIZRHLJUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O3/c23-15(13-10-19-14-5-1-2-8-22(14)16(13)24)20-7-3-4-12(11-20)21-9-6-18-17(21)25/h1-2,5,8,10,12H,3-4,6-7,9,11H2,(H,18,25).
What are the key properties of 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 341.37 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 56800022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).