potassium;N,N-dimethylformamide;iodide

C3H7IKNO — CID 87701364

IUPACpotassium;N,N-dimethylformamide;iodide
SMILESCN(C)C=O.[I-].[K+]
InChIInChI=1S/C3H7NO.HI.K/c1-4(2)3-5;;/h3H,1-2H3;1H;/q;;+1/p-1
InChIKeyKXJNZVTVRQTOOE-UHFFFAOYSA-M
MW239.10 g/mol
LogP-6.29
Rot. Bonds1

About potassium;N,N-dimethylformamide;iodide

potassium;N,N-dimethylformamide;iodide (PubChem CID 87701364) has the molecular formula C3H7IKNO and a molecular weight of 239.10 g/mol. Its IUPAC name is potassium;N,N-dimethylformamide;iodide.

Molecular Properties

Compound Namepotassium;N,N-dimethylformamide;iodide
PubChem CID87701364
Molecular FormulaC3H7IKNO
Molecular Weight239.10 g/mol
Exact Mass238.92
IUPAC Namepotassium;N,N-dimethylformamide;iodide
SMILESCN(C)C=O.[I-].[K+]
InChIInChI=1S/C3H7NO.HI.K/c1-4(2)3-5;;/h3H,1-2H3;1H;/q;;+1/p-1
InChIKeyKXJNZVTVRQTOOE-UHFFFAOYSA-M
XLogP-6.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.10
LogP ≤ 5-6.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;N,N-dimethylformamide;iodide?
The IUPAC name of potassium;N,N-dimethylformamide;iodide (CID 87701364) is potassium;N,N-dimethylformamide;iodide.
What is the SMILES notation for potassium;N,N-dimethylformamide;iodide?
The canonical SMILES for potassium;N,N-dimethylformamide;iodide is CN(C)C=O.[I-].[K+].
What is the InChIKey of potassium;N,N-dimethylformamide;iodide?
The InChIKey is KXJNZVTVRQTOOE-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H7NO.HI.K/c1-4(2)3-5;;/h3H,1-2H3;1H;/q;;+1/p-1.
What are the key properties of potassium;N,N-dimethylformamide;iodide?
potassium;N,N-dimethylformamide;iodide has a molecular weight of 239.10 g/mol, XLogP of -6.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;N,N-dimethylformamide;iodide is sourced from PubChem (CID 87701364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).