3-nitro-4-pyridin-2-ylpyridin-2-amine

C10H8N4O2 — CID 118914696

IUPAC3-nitro-4-pyridin-2-ylpyridin-2-amine
SMILESNc1nccc(-c2ccccn2)c1[N+](=O)[O-]
InChIInChI=1S/C10H8N4O2/c11-10-9(14(15)16)7(4-6-13-10)8-3-1-2-5-12-8/h1-6H,(H2,11,13)
InChIKeyPNPYAUROSLYFDO-UHFFFAOYSA-N
MW216.20 g/mol
LogP1.63
Rot. Bonds2

About 3-nitro-4-pyridin-2-ylpyridin-2-amine

3-nitro-4-pyridin-2-ylpyridin-2-amine (PubChem CID 118914696) has the molecular formula C10H8N4O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is 3-nitro-4-pyridin-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-nitro-4-pyridin-2-ylpyridin-2-amine
PubChem CID118914696
Molecular FormulaC10H8N4O2
Molecular Weight216.20 g/mol
Exact Mass216.06
IUPAC Name3-nitro-4-pyridin-2-ylpyridin-2-amine
SMILESNc1nccc(-c2ccccn2)c1[N+](=O)[O-]
InChIInChI=1S/C10H8N4O2/c11-10-9(14(15)16)7(4-6-13-10)8-3-1-2-5-12-8/h1-6H,(H2,11,13)
InChIKeyPNPYAUROSLYFDO-UHFFFAOYSA-N
XLogP1.63
TPSA94.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(4-methylphenyl)-3-nitropyridin-2-amine
CID 138986311
3-nitro-4-pyridin-2-ylphthalic acid
CID 141140668
nickel(2+);2-pyridin-2-ylpyridine;nitrate
CID 22572268
4-(6-chloro-3-pyridinyl)-3-nitropyridin-2-amine
CID 175858045
1-[3-(2-amino-3-nitro-4-pyridinyl)phenyl]-2-hydroxyethanone
CID 134432821
copper;2-pyridin-2-ylpyridine;dinitrate;trihydrate
CID 173290754
3-nitro-5-pyridin-2-ylpyridin-2-amine
CID 20556183
2-(3-nitro-2-pyridinyl)-3-pyridin-2-ylpyridine
CID 162355373
4,8-dipyridin-2-yl-1,5-naphthyridine
CID 141460445
2-nitropyridine;pyridin-2-amine
CID 160583163
2-chloro-4-pyridin-2-ylpyridin-3-amine
CID 82396148
2-nitro-5-pyridin-2-ylaniline
CID 89158283

Frequently Asked Questions

What is the IUPAC name of 3-nitro-4-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 3-nitro-4-pyridin-2-ylpyridin-2-amine (CID 118914696) is 3-nitro-4-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 3-nitro-4-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 3-nitro-4-pyridin-2-ylpyridin-2-amine is Nc1nccc(-c2ccccn2)c1[N+](=O)[O-].
What is the InChIKey of 3-nitro-4-pyridin-2-ylpyridin-2-amine?
The InChIKey is PNPYAUROSLYFDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2/c11-10-9(14(15)16)7(4-6-13-10)8-3-1-2-5-12-8/h1-6H,(H2,11,13).
What are the key properties of 3-nitro-4-pyridin-2-ylpyridin-2-amine?
3-nitro-4-pyridin-2-ylpyridin-2-amine has a molecular weight of 216.20 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-nitro-4-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 118914696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).