1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione

C10H12N4O3 — CID 62039834

IUPAC1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione
SMILESCc1[nH]ncc1CCCN1C(=O)NC(=O)C1=O
InChIInChI=1S/C10H12N4O3/c1-6-7(5-11-13-6)3-2-4-14-9(16)8(15)12-10(14)17/h5H,2-4H2,1H3,(H,11,13)(H,12,15,17)
InChIKeyZFQVHPTYUVGQPO-UHFFFAOYSA-N
MW236.23 g/mol
LogP-0.27
Rot. Bonds4

About 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione

1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione (PubChem CID 62039834) has the molecular formula C10H12N4O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione
PubChem CID62039834
Molecular FormulaC10H12N4O3
Molecular Weight236.23 g/mol
Exact Mass236.09
IUPAC Name1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione
SMILESCc1[nH]ncc1CCCN1C(=O)NC(=O)C1=O
InChIInChI=1S/C10H12N4O3/c1-6-7(5-11-13-6)3-2-4-14-9(16)8(15)12-10(14)17/h5H,2-4H2,1H3,(H,11,13)(H,12,15,17)
InChIKeyZFQVHPTYUVGQPO-UHFFFAOYSA-N
XLogP-0.27
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione?
The IUPAC name of 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione (CID 62039834) is 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione.
What is the SMILES notation for 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione?
The canonical SMILES for 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione is Cc1[nH]ncc1CCCN1C(=O)NC(=O)C1=O.
What is the InChIKey of 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione?
The InChIKey is ZFQVHPTYUVGQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O3/c1-6-7(5-11-13-6)3-2-4-14-9(16)8(15)12-10(14)17/h5H,2-4H2,1H3,(H,11,13)(H,12,15,17).
What are the key properties of 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione?
1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione has a molecular weight of 236.23 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-methyl-1H-pyrazol-4-yl)propyl]imidazolidine-2,4,5-trione is sourced from PubChem (CID 62039834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).