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

C10H8N4O2 — CID 141377887

IUPAC2-nitro-3-pyridin-3-ylpyridin-4-amine
SMILESNc1ccnc([N+](=O)[O-])c1-c1cccnc1
InChIInChI=1S/C10H8N4O2/c11-8-3-5-13-10(14(15)16)9(8)7-2-1-4-12-6-7/h1-6H,(H2,11,13)
InChIKeyYNAFMJADBJEETE-UHFFFAOYSA-N
MW216.20 g/mol
LogP1.63
Rot. Bonds2

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

2-nitro-3-pyridin-3-ylpyridin-4-amine (PubChem CID 141377887) has the molecular formula C10H8N4O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is 2-nitro-3-pyridin-3-ylpyridin-4-amine.

Molecular Properties

Compound Name2-nitro-3-pyridin-3-ylpyridin-4-amine
PubChem CID141377887
Molecular FormulaC10H8N4O2
Molecular Weight216.20 g/mol
Exact Mass216.06
IUPAC Name2-nitro-3-pyridin-3-ylpyridin-4-amine
SMILESNc1ccnc([N+](=O)[O-])c1-c1cccnc1
InChIInChI=1S/C10H8N4O2/c11-8-3-5-13-10(14(15)16)9(8)7-2-1-4-12-6-7/h1-6H,(H2,11,13)
InChIKeyYNAFMJADBJEETE-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'}

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

2-pyridin-3-ylpyridine-3,4-diamine
CID 118914760
3-methyl-2-pyridin-3-ylaniline
CID 22482419
4-chloro-2-nitro-3-phenylpyridine
CID 118850926
4-chloro-3-pyridin-3-ylpyridin-2-amine
CID 119054057
5-nitro-4-pyridin-3-ylquinoline
CID 175692098
2,4-dinitropyridin-3-amine
CID 19034991
2,3-dinitropyridine;hydrazine
CID 175406944
3-fluoro-2-nitropyridine;methane;2-nitropyridin-3-amine
CID 159866203
6-amino-5-pyridin-3-yl-1H-pyrimidin-2-one
CID 15138995
2-nitro-3-pyridin-3-ylphenol
CID 20564355
disilver;2,3-dipyridin-3-ylpyridine;dinitrate
CID 174813132
2-nitro-6-pyridin-2-yl-4-pyridin-3-ylaniline
CID 67004364

Frequently Asked Questions

What is the IUPAC name of 2-nitro-3-pyridin-3-ylpyridin-4-amine?
The IUPAC name of 2-nitro-3-pyridin-3-ylpyridin-4-amine (CID 141377887) is 2-nitro-3-pyridin-3-ylpyridin-4-amine.
What is the SMILES notation for 2-nitro-3-pyridin-3-ylpyridin-4-amine?
The canonical SMILES for 2-nitro-3-pyridin-3-ylpyridin-4-amine is Nc1ccnc([N+](=O)[O-])c1-c1cccnc1.
What is the InChIKey of 2-nitro-3-pyridin-3-ylpyridin-4-amine?
The InChIKey is YNAFMJADBJEETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2/c11-8-3-5-13-10(14(15)16)9(8)7-2-1-4-12-6-7/h1-6H,(H2,11,13).
What are the key properties of 2-nitro-3-pyridin-3-ylpyridin-4-amine?
2-nitro-3-pyridin-3-ylpyridin-4-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 2-nitro-3-pyridin-3-ylpyridin-4-amine is sourced from PubChem (CID 141377887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).