1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one

C8H13N5O2 — CID 106399247

IUPAC1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNCc1ncon1
InChIInChI=1S/C8H13N5O2/c14-8-10-2-4-13(8)3-1-9-5-7-11-6-15-12-7/h6,9H,1-5H2,(H,10,14)
InChIKeyFLPPIPWAJGMUAZ-UHFFFAOYSA-N
MW211.22 g/mol
LogP-0.82
Rot. Bonds5

About 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one

1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one (PubChem CID 106399247) has the molecular formula C8H13N5O2 and a molecular weight of 211.22 g/mol. Its IUPAC name is 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one
PubChem CID106399247
Molecular FormulaC8H13N5O2
Molecular Weight211.22 g/mol
Exact Mass211.11
IUPAC Name1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNCc1ncon1
InChIInChI=1S/C8H13N5O2/c14-8-10-2-4-13(8)3-1-9-5-7-11-6-15-12-7/h6,9H,1-5H2,(H,10,14)
InChIKeyFLPPIPWAJGMUAZ-UHFFFAOYSA-N
XLogP-0.82
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one 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-[2-[(2-methyl-1,3-thiazol-5-yl)methylamino]ethyl]imidazolidin-2-one
CID 61282388
1-[2-[(6-methoxy-3-pyridinyl)methylamino]ethyl]imidazolidin-2-one
CID 62990467
1-[2-[(4-chlorophenyl)methylamino]ethyl]imidazolidin-2-one
CID 28738658
1-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]ethyl]imidazolidin-2-one
CID 112669012
1-[2-(2-pyridin-4-ylethylamino)ethyl]imidazolidin-2-one
CID 60904196
1-[2-[(2-pyrazol-1-ylphenyl)methylamino]ethyl]imidazolidin-2-one
CID 61166922
1-[2-[(3-fluorophenyl)methylamino]ethyl]imidazolidin-2-one
CID 28970678
1-[2-[[3-(hydroxymethyl)phenyl]methylamino]ethyl]imidazolidin-2-one
CID 107230430
1-[2-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methylamino]ethyl]imidazolidin-2-one
CID 28734589
ethane;1-[2-(methylamino)ethyl]imidazolidin-2-one
CID 142017156
1,3-dimethyl-5-[(1,2,4-oxadiazol-3-ylmethylamino)methyl]pyrimidine-2,4-dione
CID 106393533
1-[2-(octylamino)ethyl]imidazolidin-2-one
CID 113337199

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one (CID 106399247) is 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one is O=C1NCCN1CCNCc1ncon1.
What is the InChIKey of 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one?
The InChIKey is FLPPIPWAJGMUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O2/c14-8-10-2-4-13(8)3-1-9-5-7-11-6-15-12-7/h6,9H,1-5H2,(H,10,14).
What are the key properties of 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one?
1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one has a molecular weight of 211.22 g/mol, XLogP of -0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,2,4-oxadiazol-3-ylmethylamino)ethyl]imidazolidin-2-one is sourced from PubChem (CID 106399247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).