hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one

C9H12N4O2 — CID 134891555

IUPAChydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one
SMILESNN.O=c1[nH][nH]c(O)c1-c1ccccc1
InChIInChI=1S/C9H8N2O2.H4N2/c12-8-7(9(13)11-10-8)6-4-2-1-3-5-6;1-2/h1-5H,(H3,10,11,12,13);1-2H2
InChIKeyBTTUZSZPLOFXOT-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.11
Rot. Bonds1

About hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one

hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one (PubChem CID 134891555) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one.

Molecular Properties

Compound Namehydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one
PubChem CID134891555
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Namehydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one
SMILESNN.O=c1[nH][nH]c(O)c1-c1ccccc1
InChIInChI=1S/C9H8N2O2.H4N2/c12-8-7(9(13)11-10-8)6-4-2-1-3-5-6;1-2/h1-5H,(H3,10,11,12,13);1-2H2
InChIKeyBTTUZSZPLOFXOT-UHFFFAOYSA-N
XLogP-0.11
TPSA120.92 Ų
H-Bond Donors5
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.11
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one 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 hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one?
The IUPAC name of hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one (CID 134891555) is hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one.
What is the SMILES notation for hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one?
The canonical SMILES for hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one is NN.O=c1[nH][nH]c(O)c1-c1ccccc1.
What is the InChIKey of hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one?
The InChIKey is BTTUZSZPLOFXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2.H4N2/c12-8-7(9(13)11-10-8)6-4-2-1-3-5-6;1-2/h1-5H,(H3,10,11,12,13);1-2H2.
What are the key properties of hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one?
hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one has a molecular weight of 208.22 g/mol, XLogP of -0.11, 1 rotatable bonds, 5 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;5-hydroxy-4-phenyl-1,2-dihydropyrazol-3-one is sourced from PubChem (CID 134891555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).