(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine

C12H10N6O2 — CID 80902122

IUPAC(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(-n2ncc3ccccc32)n1
InChIInChI=1S/C12H10N6O2/c13-16-11-6-5-10(18(19)20)12(15-11)17-9-4-2-1-3-8(9)7-14-17/h1-7H,13H2,(H,15,16)
InChIKeyFVOHLFVPBQTYQT-UHFFFAOYSA-N
MW270.25 g/mol
LogP1.61
Rot. Bonds3

About (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine

(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine (PubChem CID 80902122) has the molecular formula C12H10N6O2 and a molecular weight of 270.25 g/mol. Its IUPAC name is (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine
PubChem CID80902122
Molecular FormulaC12H10N6O2
Molecular Weight270.25 g/mol
Exact Mass270.09
IUPAC Name(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(-n2ncc3ccccc32)n1
InChIInChI=1S/C12H10N6O2/c13-16-11-6-5-10(18(19)20)12(15-11)17-9-4-2-1-3-8(9)7-14-17/h1-7H,13H2,(H,15,16)
InChIKeyFVOHLFVPBQTYQT-UHFFFAOYSA-N
XLogP1.61
TPSA111.90 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', '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 (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine?
The IUPAC name of (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine (CID 80902122) is (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine.
What is the SMILES notation for (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine?
The canonical SMILES for (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine is NNc1ccc([N+](=O)[O-])c(-n2ncc3ccccc32)n1.
What is the InChIKey of (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine?
The InChIKey is FVOHLFVPBQTYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6O2/c13-16-11-6-5-10(18(19)20)12(15-11)17-9-4-2-1-3-8(9)7-14-17/h1-7H,13H2,(H,15,16).
What are the key properties of (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine?
(6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine has a molecular weight of 270.25 g/mol, XLogP of 1.61, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6-indazol-1-yl-5-nitro-2-pyridinyl)hydrazine is sourced from PubChem (CID 80902122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).