(6-methoxy-5-nitro-3-pyridinyl)hydrazine

C6H8N4O3 — CID 169171499

IUPAC(6-methoxy-5-nitro-3-pyridinyl)hydrazine
SMILESCOc1ncc(NN)cc1[N+](=O)[O-]
InChIInChI=1S/C6H8N4O3/c1-13-6-5(10(11)12)2-4(9-7)3-8-6/h2-3,9H,7H2,1H3
InChIKeyPTAUDJDIFFWFDF-UHFFFAOYSA-N
MW184.16 g/mol
LogP0.28
Rot. Bonds3

About (6-methoxy-5-nitro-3-pyridinyl)hydrazine

(6-methoxy-5-nitro-3-pyridinyl)hydrazine (PubChem CID 169171499) has the molecular formula C6H8N4O3 and a molecular weight of 184.16 g/mol. Its IUPAC name is (6-methoxy-5-nitro-3-pyridinyl)hydrazine.

Molecular Properties

Compound Name(6-methoxy-5-nitro-3-pyridinyl)hydrazine
PubChem CID169171499
Molecular FormulaC6H8N4O3
Molecular Weight184.16 g/mol
Exact Mass184.06
IUPAC Name(6-methoxy-5-nitro-3-pyridinyl)hydrazine
SMILESCOc1ncc(NN)cc1[N+](=O)[O-]
InChIInChI=1S/C6H8N4O3/c1-13-6-5(10(11)12)2-4(9-7)3-8-6/h2-3,9H,7H2,1H3
InChIKeyPTAUDJDIFFWFDF-UHFFFAOYSA-N
XLogP0.28
TPSA103.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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'}

Analyze (6-methoxy-5-nitro-3-pyridinyl)hydrazine 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 (6-methoxy-5-nitro-3-pyridinyl)hydrazine?
The IUPAC name of (6-methoxy-5-nitro-3-pyridinyl)hydrazine (CID 169171499) is (6-methoxy-5-nitro-3-pyridinyl)hydrazine.
What is the SMILES notation for (6-methoxy-5-nitro-3-pyridinyl)hydrazine?
The canonical SMILES for (6-methoxy-5-nitro-3-pyridinyl)hydrazine is COc1ncc(NN)cc1[N+](=O)[O-].
What is the InChIKey of (6-methoxy-5-nitro-3-pyridinyl)hydrazine?
The InChIKey is PTAUDJDIFFWFDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O3/c1-13-6-5(10(11)12)2-4(9-7)3-8-6/h2-3,9H,7H2,1H3.
What are the key properties of (6-methoxy-5-nitro-3-pyridinyl)hydrazine?
(6-methoxy-5-nitro-3-pyridinyl)hydrazine has a molecular weight of 184.16 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-5-nitro-3-pyridinyl)hydrazine is sourced from PubChem (CID 169171499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).