6-hydrazinyl-5-nitropyridine-3-carbonitrile

C6H5N5O2 — CID 103470111

IUPAC6-hydrazinyl-5-nitropyridine-3-carbonitrile
SMILESN#Cc1cnc(NN)c([N+](=O)[O-])c1
InChIInChI=1S/C6H5N5O2/c7-2-4-1-5(11(12)13)6(10-8)9-3-4/h1,3H,8H2,(H,9,10)
InChIKeyGHCWYWFSWJXFLF-UHFFFAOYSA-N
MW179.14 g/mol
LogP0.15
Rot. Bonds2

About 6-hydrazinyl-5-nitropyridine-3-carbonitrile

6-hydrazinyl-5-nitropyridine-3-carbonitrile (PubChem CID 103470111) has the molecular formula C6H5N5O2 and a molecular weight of 179.14 g/mol. Its IUPAC name is 6-hydrazinyl-5-nitropyridine-3-carbonitrile.

Molecular Properties

Compound Name6-hydrazinyl-5-nitropyridine-3-carbonitrile
PubChem CID103470111
Molecular FormulaC6H5N5O2
Molecular Weight179.14 g/mol
Exact Mass179.04
IUPAC Name6-hydrazinyl-5-nitropyridine-3-carbonitrile
SMILESN#Cc1cnc(NN)c([N+](=O)[O-])c1
InChIInChI=1S/C6H5N5O2/c7-2-4-1-5(11(12)13)6(10-8)9-3-4/h1,3H,8H2,(H,9,10)
InChIKeyGHCWYWFSWJXFLF-UHFFFAOYSA-N
XLogP0.15
TPSA117.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.14
LogP ≤ 50.15
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-hydrazinyl-5-nitropyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(1-cyanocyclopropyl)methylamino]-5-nitropyridine-3-carbonitrile
CID 170427998
6-[(4-hydroxy-2-methylbutan-2-yl)amino]-5-nitropyridine-3-carbonitrile
CID 103472091
6-(cyclobutylmethylamino)-5-nitropyridine-3-carbonitrile
CID 103471221
3-[(5-cyano-3-nitro-2-pyridinyl)amino]-2,2,3-trimethylbutanoic acid
CID 103469988
6-[(4,4-dimethylcyclohexyl)amino]-5-nitropyridine-3-carbonitrile
CID 103471718
6-[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]amino]-5-nitropyridine-3-carbonitrile
CID 107866246
6-(1-methylsulfanylbutan-2-ylamino)-5-nitropyridine-3-carbonitrile
CID 103472069
6-(1H-imidazol-5-ylmethylamino)-5-nitropyridine-3-carbonitrile
CID 103471795
6-[(2-methylcyclopentyl)amino]-5-nitropyridine-3-carbonitrile
CID 103471641
5-nitro-6-(oxetan-2-ylmethylamino)pyridine-3-carbonitrile
CID 170428144
6-[(1,1-dioxothiolan-3-yl)amino]-5-nitropyridine-3-carbonitrile
CID 103471174
5-nitro-6-[(1-propan-2-ylpyrazol-4-yl)amino]pyridine-3-carbonitrile
CID 103471615

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-nitropyridine-3-carbonitrile?
The IUPAC name of 6-hydrazinyl-5-nitropyridine-3-carbonitrile (CID 103470111) is 6-hydrazinyl-5-nitropyridine-3-carbonitrile.
What is the SMILES notation for 6-hydrazinyl-5-nitropyridine-3-carbonitrile?
The canonical SMILES for 6-hydrazinyl-5-nitropyridine-3-carbonitrile is N#Cc1cnc(NN)c([N+](=O)[O-])c1.
What is the InChIKey of 6-hydrazinyl-5-nitropyridine-3-carbonitrile?
The InChIKey is GHCWYWFSWJXFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5O2/c7-2-4-1-5(11(12)13)6(10-8)9-3-4/h1,3H,8H2,(H,9,10).
What are the key properties of 6-hydrazinyl-5-nitropyridine-3-carbonitrile?
6-hydrazinyl-5-nitropyridine-3-carbonitrile has a molecular weight of 179.14 g/mol, XLogP of 0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-nitropyridine-3-carbonitrile is sourced from PubChem (CID 103470111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).