3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid

C11H19N3O3 — CID 102549085

IUPAC3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid
SMILESO=C(O)CCN1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C11H19N3O3/c15-10(16)3-6-13-5-1-2-9(8-13)14-7-4-12-11(14)17/h9H,1-8H2,(H,12,17)(H,15,16)
InChIKeyHCXJLECAEDNARH-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.05
Rot. Bonds4

About 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid

3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid (PubChem CID 102549085) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid.

Molecular Properties

Compound Name3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid
PubChem CID102549085
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid
SMILESO=C(O)CCN1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C11H19N3O3/c15-10(16)3-6-13-5-1-2-9(8-13)14-7-4-12-11(14)17/h9H,1-8H2,(H,12,17)(H,15,16)
InChIKeyHCXJLECAEDNARH-UHFFFAOYSA-N
XLogP-0.05
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-3-[(3R)-3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanamide
CID 95326703
1-[(3R)-1-(2-phenylsulfanylethyl)piperidin-3-yl]imidazolidin-2-one
CID 95771278
3-[(3R)-3-pyrrolidin-1-ylpiperidin-1-yl]propanoic acid
CID 95599765
1-(1-benzylpiperidin-3-yl)imidazolidin-2-one
CID 78980069
1-[1-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]piperidin-3-yl]imidazolidin-2-one
CID 56799959
1-(1-propylpyrrolidin-3-yl)imidazolidin-2-one
CID 131114947
3-[3-(4-ethylpiperazin-1-yl)piperidin-1-yl]propanoic acid
CID 84755522
3-[(3R)-3-methylpiperidin-1-yl]propanoic acid
CID 7258528
3-[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]sulfonylpropanoic acid
CID 60952185
1-(1-propylazetidin-3-yl)imidazolidin-2-one
CID 130647808
(3R)-N-benzyl-3-(2-oxoimidazolidin-1-yl)piperidine-1-carboxamide
CID 95047911
1-[(3R)-1-[(5-bromothiophen-3-yl)methyl]piperidin-3-yl]imidazolidin-2-one
CID 94216420

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid?
The IUPAC name of 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid (CID 102549085) is 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid.
What is the SMILES notation for 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid?
The canonical SMILES for 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid is O=C(O)CCN1CCCC(N2CCNC2=O)C1.
What is the InChIKey of 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid?
The InChIKey is HCXJLECAEDNARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c15-10(16)3-6-13-5-1-2-9(8-13)14-7-4-12-11(14)17/h9H,1-8H2,(H,12,17)(H,15,16).
What are the key properties of 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid?
3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid has a molecular weight of 241.29 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]propanoic acid is sourced from PubChem (CID 102549085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).