5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide

C9H11N7O — CID 107377514

IUPAC5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
SMILESCn1ccc(NC(=O)c2cnc(NN)cn2)n1
InChIInChI=1S/C9H11N7O/c1-16-3-2-7(15-16)13-9(17)6-4-12-8(14-10)5-11-6/h2-5H,10H2,1H3,(H,12,14)(H,13,15,17)
InChIKeyVBFLSNDUPYXBQE-UHFFFAOYSA-N
MW233.24 g/mol
LogP-0.25
Rot. Bonds3

About 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide

5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide (PubChem CID 107377514) has the molecular formula C9H11N7O and a molecular weight of 233.24 g/mol. Its IUPAC name is 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
PubChem CID107377514
Molecular FormulaC9H11N7O
Molecular Weight233.24 g/mol
Exact Mass233.10
IUPAC Name5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
SMILESCn1ccc(NC(=O)c2cnc(NN)cn2)n1
InChIInChI=1S/C9H11N7O/c1-16-3-2-7(15-16)13-9(17)6-4-12-8(14-10)5-11-6/h2-5H,10H2,1H3,(H,12,14)(H,13,15,17)
InChIKeyVBFLSNDUPYXBQE-UHFFFAOYSA-N
XLogP-0.25
TPSA110.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide (CID 107377514) is 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide is Cn1ccc(NC(=O)c2cnc(NN)cn2)n1.
What is the InChIKey of 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide?
The InChIKey is VBFLSNDUPYXBQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N7O/c1-16-3-2-7(15-16)13-9(17)6-4-12-8(14-10)5-11-6/h2-5H,10H2,1H3,(H,12,14)(H,13,15,17).
What are the key properties of 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide?
5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide has a molecular weight of 233.24 g/mol, XLogP of -0.25, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 107377514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).