potassium N-methanidylpyridin-2-amine

C6H7KN2 — CID 153353371

IUPACpotassium N-methanidylpyridin-2-amine
SMILES[CH2-]Nc1ccccn1.[K+]
InChIInChI=1S/C6H7N2.K/c1-7-6-4-2-3-5-8-6;/h2-5H,1H2,(H,7,8);/q-1;+1
InChIKeyBPBXDVAZNAWXCQ-UHFFFAOYSA-N
MW146.23 g/mol
LogP-1.71
Rot. Bonds1

About potassium N-methanidylpyridin-2-amine

potassium N-methanidylpyridin-2-amine (PubChem CID 153353371) has the molecular formula C6H7KN2 and a molecular weight of 146.23 g/mol. Its IUPAC name is potassium N-methanidylpyridin-2-amine.

Molecular Properties

Compound Namepotassium N-methanidylpyridin-2-amine
PubChem CID153353371
Molecular FormulaC6H7KN2
Molecular Weight146.23 g/mol
Exact Mass146.02
IUPAC Namepotassium N-methanidylpyridin-2-amine
SMILES[CH2-]Nc1ccccn1.[K+]
InChIInChI=1S/C6H7N2.K/c1-7-6-4-2-3-5-8-6;/h2-5H,1H2,(H,7,8);/q-1;+1
InChIKeyBPBXDVAZNAWXCQ-UHFFFAOYSA-N
XLogP-1.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 5-1.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium N-methanidylpyridin-2-amine?
The IUPAC name of potassium N-methanidylpyridin-2-amine (CID 153353371) is potassium N-methanidylpyridin-2-amine.
What is the SMILES notation for potassium N-methanidylpyridin-2-amine?
The canonical SMILES for potassium N-methanidylpyridin-2-amine is [CH2-]Nc1ccccn1.[K+].
What is the InChIKey of potassium N-methanidylpyridin-2-amine?
The InChIKey is BPBXDVAZNAWXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N2.K/c1-7-6-4-2-3-5-8-6;/h2-5H,1H2,(H,7,8);/q-1;+1.
What are the key properties of potassium N-methanidylpyridin-2-amine?
potassium N-methanidylpyridin-2-amine has a molecular weight of 146.23 g/mol, XLogP of -1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium N-methanidylpyridin-2-amine is sourced from PubChem (CID 153353371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).