potassium;prop-2-enamide;chloride

C3H5ClKNO — CID 161245795

IUPACpotassium;prop-2-enamide;chloride
SMILESC=CC(N)=O.[Cl-].[K+]
InChIInChI=1S/C3H5NO.ClH.K/c1-2-3(4)5;;/h2H,1H2,(H2,4,5);1H;/q;;+1/p-1
InChIKeyVAPSXCZWELHVGY-UHFFFAOYSA-M
MW145.63 g/mol
LogP-6.33
Rot. Bonds1

About potassium;prop-2-enamide;chloride

potassium;prop-2-enamide;chloride (PubChem CID 161245795) has the molecular formula C3H5ClKNO and a molecular weight of 145.63 g/mol. Its IUPAC name is potassium;prop-2-enamide;chloride.

Molecular Properties

Compound Namepotassium;prop-2-enamide;chloride
PubChem CID161245795
Molecular FormulaC3H5ClKNO
Molecular Weight145.63 g/mol
Exact Mass144.97
IUPAC Namepotassium;prop-2-enamide;chloride
SMILESC=CC(N)=O.[Cl-].[K+]
InChIInChI=1S/C3H5NO.ClH.K/c1-2-3(4)5;;/h2H,1H2,(H2,4,5);1H;/q;;+1/p-1
InChIKeyVAPSXCZWELHVGY-UHFFFAOYSA-M
XLogP-6.33
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.63
LogP ≤ 5-6.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

CID 118976628
CID 118976628
prop-2-enamide iodide
CID 19796963
prop-2-enamide;ruthenium
CID 90254548
CID 175387410
CID 175387410
molecular hydrogen;prop-2-enamide
CID 156651584
magnesium;prop-2-enamide;dihydroxide
CID 175298952
methanamine;prop-2-enamide;hydrate
CID 174696935
ethene-1,1-diol;prop-2-enamide
CID 174658864
acetamide;prop-2-enamide
CID 158566181
phosphoric acid;bis(prop-2-enamide)
CID 175358091
ethane-1,2-diamine;bis(prop-2-enamide)
CID 23336954
benzene;prop-2-enamide;hydrobromide
CID 174943070

Frequently Asked Questions

What is the IUPAC name of potassium;prop-2-enamide;chloride?
The IUPAC name of potassium;prop-2-enamide;chloride (CID 161245795) is potassium;prop-2-enamide;chloride.
What is the SMILES notation for potassium;prop-2-enamide;chloride?
The canonical SMILES for potassium;prop-2-enamide;chloride is C=CC(N)=O.[Cl-].[K+].
What is the InChIKey of potassium;prop-2-enamide;chloride?
The InChIKey is VAPSXCZWELHVGY-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H5NO.ClH.K/c1-2-3(4)5;;/h2H,1H2,(H2,4,5);1H;/q;;+1/p-1.
What are the key properties of potassium;prop-2-enamide;chloride?
potassium;prop-2-enamide;chloride has a molecular weight of 145.63 g/mol, XLogP of -6.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;prop-2-enamide;chloride is sourced from PubChem (CID 161245795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).