3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium

C11H18N3O3Y- — CID 58834900

IUPAC3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium
SMILESO=C(O)CCN1CCC(N2[CH-]CNC2=O)CC1.[Y]
InChIInChI=1S/C11H18N3O3.Y/c15-10(16)3-7-13-5-1-9(2-6-13)14-8-4-12-11(14)17;/h8-9H,1-7H2,(H,12,17)(H,15,16);/q-1;
InChIKeyAURBDWMUZWYANG-UHFFFAOYSA-N
MW329.19 g/mol
LogP0.11
Rot. Bonds4

About 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium

3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium (PubChem CID 58834900) has the molecular formula C11H18N3O3Y- and a molecular weight of 329.19 g/mol. Its IUPAC name is 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium.

Molecular Properties

Compound Name3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium
PubChem CID58834900
Molecular FormulaC11H18N3O3Y-
Molecular Weight329.19 g/mol
Exact Mass329.04
IUPAC Name3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium
SMILESO=C(O)CCN1CCC(N2[CH-]CNC2=O)CC1.[Y]
InChIInChI=1S/C11H18N3O3.Y/c15-10(16)3-7-13-5-1-9(2-6-13)14-8-4-12-11(14)17;/h8-9H,1-7H2,(H,12,17)(H,15,16);/q-1;
InChIKeyAURBDWMUZWYANG-UHFFFAOYSA-N
XLogP0.11
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.19
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Piperidin-4-ylimidazolidin-2-one;2,2,2-trifluoroacetic acid
CID 143265147
3-[(4-Piperidin-1-ylpiperidine-1-carbonyl)amino]propanoic acid
CID 19358567
3-(Piperidine-1-carbonylamino)propanoic acid
CID 28510474
3-[[(1-Ethylpiperidin-4-yl)-methylcarbamoyl]amino]propanoic acid
CID 55002551
3-[[Methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]propanoic acid
CID 61191985
3-[(4-Propan-2-ylpiperazine-1-carbonyl)amino]propanoic acid
CID 61200863
3-[(4-Aminopiperidine-1-carbonyl)amino]propanoic acid
CID 61402662
3-[(3-Aminopyrrolidine-1-carbonyl)amino]propanoic acid
CID 62067907
(2S)-2-amino-3-[[4-(dimethylamino)piperidine-1-carbonyl]amino]propanoic acid
CID 67154462
Piperidine-1-carboxamide;3-(propan-2-ylamino)propanoic acid
CID 68551275
1-(Pyrrolidine-1-carbonyl)piperazine-2-carboxylic acid
CID 69235282
2-Amino-3-[[4-(dimethylamino)piperidine-1-carbonyl]amino]propanoic acid
CID 70944814

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium?
The IUPAC name of 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium (CID 58834900) is 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium.
What is the SMILES notation for 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium?
The canonical SMILES for 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium is O=C(O)CCN1CCC(N2[CH-]CNC2=O)CC1.[Y].
What is the InChIKey of 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium?
The InChIKey is AURBDWMUZWYANG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N3O3.Y/c15-10(16)3-7-13-5-1-9(2-6-13)14-8-4-12-11(14)17;/h8-9H,1-7H2,(H,12,17)(H,15,16);/q-1;.
What are the key properties of 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium?
3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium has a molecular weight of 329.19 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-oxoimidazolidin-5-id-1-yl)piperidin-1-yl]propanoic acid;yttrium is sourced from PubChem (CID 58834900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).