potassium 3H-pyridin-3-id-4-ylmethylideneazanide

C6H4KN2- — CID 59939662

IUPACpotassium 3H-pyridin-3-id-4-ylmethylideneazanide
SMILES[K+].[N-]=Cc1[c-]cncc1
InChIInChI=1S/C6H4N2.K/c7-5-6-1-3-8-4-2-6;/h1,3-5H;/q-2;+1
InChIKeyPFLJDVXBCNYCMA-UHFFFAOYSA-N
MW143.21 g/mol
LogP-2.13
Rot. Bonds1

About potassium 3H-pyridin-3-id-4-ylmethylideneazanide

potassium 3H-pyridin-3-id-4-ylmethylideneazanide (PubChem CID 59939662) has the molecular formula C6H4KN2- and a molecular weight of 143.21 g/mol. Its IUPAC name is potassium 3H-pyridin-3-id-4-ylmethylideneazanide.

Molecular Properties

Compound Namepotassium 3H-pyridin-3-id-4-ylmethylideneazanide
PubChem CID59939662
Molecular FormulaC6H4KN2-
Molecular Weight143.21 g/mol
Exact Mass143.00
IUPAC Namepotassium 3H-pyridin-3-id-4-ylmethylideneazanide
SMILES[K+].[N-]=Cc1[c-]cncc1
InChIInChI=1S/C6H4N2.K/c7-5-6-1-3-8-4-2-6;/h1,3-5H;/q-2;+1
InChIKeyPFLJDVXBCNYCMA-UHFFFAOYSA-N
XLogP-2.13
TPSA35.19 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 5-2.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium 3H-pyridin-3-id-4-ylmethylideneazanide?
The IUPAC name of potassium 3H-pyridin-3-id-4-ylmethylideneazanide (CID 59939662) is potassium 3H-pyridin-3-id-4-ylmethylideneazanide.
What is the SMILES notation for potassium 3H-pyridin-3-id-4-ylmethylideneazanide?
The canonical SMILES for potassium 3H-pyridin-3-id-4-ylmethylideneazanide is [K+].[N-]=Cc1[c-]cncc1.
What is the InChIKey of potassium 3H-pyridin-3-id-4-ylmethylideneazanide?
The InChIKey is PFLJDVXBCNYCMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2.K/c7-5-6-1-3-8-4-2-6;/h1,3-5H;/q-2;+1.
What are the key properties of potassium 3H-pyridin-3-id-4-ylmethylideneazanide?
potassium 3H-pyridin-3-id-4-ylmethylideneazanide has a molecular weight of 143.21 g/mol, XLogP of -2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 3H-pyridin-3-id-4-ylmethylideneazanide is sourced from PubChem (CID 59939662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).