5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide

C9H10N4O2 — CID 727435

IUPAC5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide
SMILESCc1ccc(-c2cc(C(=O)NN)n[nH]2)o1
InChIInChI=1S/C9H10N4O2/c1-5-2-3-8(15-5)6-4-7(13-12-6)9(14)11-10/h2-4H,10H2,1H3,(H,11,14)(H,12,13)
InChIKeyZXRCSEZSNYNNAD-UHFFFAOYSA-N
MW206.21 g/mol
LogP0.58
Rot. Bonds2

About 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide

5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide (PubChem CID 727435) has the molecular formula C9H10N4O2 and a molecular weight of 206.21 g/mol. Its IUPAC name is 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide.

Molecular Properties

Compound Name5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide
PubChem CID727435
Molecular FormulaC9H10N4O2
Molecular Weight206.21 g/mol
Exact Mass206.08
IUPAC Name5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide
SMILESCc1ccc(-c2cc(C(=O)NN)n[nH]2)o1
InChIInChI=1S/C9H10N4O2/c1-5-2-3-8(15-5)6-4-7(13-12-6)9(14)11-10/h2-4H,10H2,1H3,(H,11,14)(H,12,13)
InChIKeyZXRCSEZSNYNNAD-UHFFFAOYSA-N
XLogP0.58
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide 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 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide?
The IUPAC name of 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide (CID 727435) is 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide.
What is the SMILES notation for 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide?
The canonical SMILES for 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide is Cc1ccc(-c2cc(C(=O)NN)n[nH]2)o1.
What is the InChIKey of 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide?
The InChIKey is ZXRCSEZSNYNNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c1-5-2-3-8(15-5)6-4-7(13-12-6)9(14)11-10/h2-4H,10H2,1H3,(H,11,14)(H,12,13).
What are the key properties of 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide?
5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide has a molecular weight of 206.21 g/mol, XLogP of 0.58, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide is sourced from PubChem (CID 727435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).