(2-methyl-3-pyridinyl)iminoazanium

C6H8N3+ — CID 23555918

IUPAC(2-methyl-3-pyridinyl)iminoazanium
SMILESCc1ncccc1N=[NH2+]
InChIInChI=1S/C6H7N3/c1-5-6(9-7)3-2-4-8-5/h2-4,7H,1H3/p+1
InChIKeySAKORAXHFLPPSS-UHFFFAOYSA-O
MW122.15 g/mol
LogP0.23
Rot. Bonds1

About (2-methyl-3-pyridinyl)iminoazanium

(2-methyl-3-pyridinyl)iminoazanium (PubChem CID 23555918) has the molecular formula C6H8N3+ and a molecular weight of 122.15 g/mol. Its IUPAC name is (2-methyl-3-pyridinyl)iminoazanium.

Molecular Properties

Compound Name(2-methyl-3-pyridinyl)iminoazanium
PubChem CID23555918
Molecular FormulaC6H8N3+
Molecular Weight122.15 g/mol
Exact Mass122.07
IUPAC Name(2-methyl-3-pyridinyl)iminoazanium
SMILESCc1ncccc1N=[NH2+]
InChIInChI=1S/C6H7N3/c1-5-6(9-7)3-2-4-8-5/h2-4,7H,1H3/p+1
InChIKeySAKORAXHFLPPSS-UHFFFAOYSA-O
XLogP0.23
TPSA50.84 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.15
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze (2-methyl-3-pyridinyl)iminoazanium 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

1-[(2-methyl-3-pyridinyl)imino]thietane 1-oxide
CID 176929429
bis(2,3-dimethylpyridine);ethane
CID 159594018
carbon dioxide;2-methylpyridin-3-amine
CID 157100546
2-methylpyridin-3-amine;hydroiodide
CID 172837374
2,3-dimethylpyridine;1,4-xylene
CID 174745079
azane;2-methylpyridin-3-amine
CID 67996717
3-chloro-2-methylpyridine;dichloromethane
CID 174920232
3-chloro-2-methylpyridine;formaldehyde
CID 175449044
ethane;2-methyl-3-propan-2-ylpyridine
CID 142858508
3-fluoro-2-methylpyridine;propane
CID 171848252
2-methyl-3-(trifluoromethyl)pyridine
CID 14761443
3-tert-butyl-2-methylpyridine;ethane
CID 90980079

Frequently Asked Questions

What is the IUPAC name of (2-methyl-3-pyridinyl)iminoazanium?
The IUPAC name of (2-methyl-3-pyridinyl)iminoazanium (CID 23555918) is (2-methyl-3-pyridinyl)iminoazanium.
What is the SMILES notation for (2-methyl-3-pyridinyl)iminoazanium?
The canonical SMILES for (2-methyl-3-pyridinyl)iminoazanium is Cc1ncccc1N=[NH2+].
What is the InChIKey of (2-methyl-3-pyridinyl)iminoazanium?
The InChIKey is SAKORAXHFLPPSS-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H7N3/c1-5-6(9-7)3-2-4-8-5/h2-4,7H,1H3/p+1.
What are the key properties of (2-methyl-3-pyridinyl)iminoazanium?
(2-methyl-3-pyridinyl)iminoazanium has a molecular weight of 122.15 g/mol, XLogP of 0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3-pyridinyl)iminoazanium is sourced from PubChem (CID 23555918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).