1-(1,2,4-triazol-1-yl)imidazolidin-2-one

C5H7N5O — CID 150408021

IUPAC1-(1,2,4-triazol-1-yl)imidazolidin-2-one
SMILESO=C1NCCN1n1cncn1
InChIInChI=1S/C5H7N5O/c11-5-7-1-2-9(5)10-4-6-3-8-10/h3-4H,1-2H2,(H,7,11)
InChIKeyHFELKUYXJKJWNT-UHFFFAOYSA-N
MW153.15 g/mol
LogP-1.06
Rot. Bonds1

About 1-(1,2,4-triazol-1-yl)imidazolidin-2-one

1-(1,2,4-triazol-1-yl)imidazolidin-2-one (PubChem CID 150408021) has the molecular formula C5H7N5O and a molecular weight of 153.15 g/mol. Its IUPAC name is 1-(1,2,4-triazol-1-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(1,2,4-triazol-1-yl)imidazolidin-2-one
PubChem CID150408021
Molecular FormulaC5H7N5O
Molecular Weight153.15 g/mol
Exact Mass153.07
IUPAC Name1-(1,2,4-triazol-1-yl)imidazolidin-2-one
SMILESO=C1NCCN1n1cncn1
InChIInChI=1S/C5H7N5O/c11-5-7-1-2-9(5)10-4-6-3-8-10/h3-4H,1-2H2,(H,7,11)
InChIKeyHFELKUYXJKJWNT-UHFFFAOYSA-N
XLogP-1.06
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.15
LogP ≤ 5-1.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1,2,4-triazol-1-yl)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-pyrrolidin-1-yl-1,2,4-triazole
CID 69380848
3-methyl-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-2-one
CID 136523920
3-methyl-4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-2-one
CID 55219544
4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-2-one
CID 60718090
1-[2-(1,2,4-triazol-1-yl)propanoyl]-1,4-diazepan-5-one
CID 62046983
3,3-dimethyl-4-[3-(1,2,4-triazol-1-yl)propanoyl]piperazin-2-one
CID 63607225
3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione
CID 159953600
1-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-2-one
CID 130559424
1-(1H-imidazol-5-yl)imidazolidin-2-one
CID 68787886
4-[4-(ethylamino)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-yl]piperazin-2-one
CID 80749613
1-(4-nitropyrazol-1-yl)-1,2,4-triazole
CID 141178933
1-[2-(2-pyridin-4-ylethylamino)ethyl]imidazolidin-2-one
CID 60904196

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,4-triazol-1-yl)imidazolidin-2-one?
The IUPAC name of 1-(1,2,4-triazol-1-yl)imidazolidin-2-one (CID 150408021) is 1-(1,2,4-triazol-1-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(1,2,4-triazol-1-yl)imidazolidin-2-one?
The canonical SMILES for 1-(1,2,4-triazol-1-yl)imidazolidin-2-one is O=C1NCCN1n1cncn1.
What is the InChIKey of 1-(1,2,4-triazol-1-yl)imidazolidin-2-one?
The InChIKey is HFELKUYXJKJWNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N5O/c11-5-7-1-2-9(5)10-4-6-3-8-10/h3-4H,1-2H2,(H,7,11).
What are the key properties of 1-(1,2,4-triazol-1-yl)imidazolidin-2-one?
1-(1,2,4-triazol-1-yl)imidazolidin-2-one has a molecular weight of 153.15 g/mol, XLogP of -1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,4-triazol-1-yl)imidazolidin-2-one is sourced from PubChem (CID 150408021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).