potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid

C5H10KNO4S — CID 173360160

IUPACpotassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid
SMILESC=C(C)C(=O)NCS(=O)(=O)O.[H-].[K+]
InChIInChI=1S/C5H9NO4S.K.H/c1-4(2)5(7)6-3-11(8,9)10;;/h1,3H2,2H3,(H,6,7)(H,8,9,10);;/q;+1;-1
InChIKeySEJYOYJHDVPSRV-UHFFFAOYSA-N
MW219.30 g/mol
LogP-3.36
Rot. Bonds3

About potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid

potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid (PubChem CID 173360160) has the molecular formula C5H10KNO4S and a molecular weight of 219.30 g/mol. Its IUPAC name is potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid.

Molecular Properties

Compound Namepotassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid
PubChem CID173360160
Molecular FormulaC5H10KNO4S
Molecular Weight219.30 g/mol
Exact Mass219.00
IUPAC Namepotassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid
SMILESC=C(C)C(=O)NCS(=O)(=O)O.[H-].[K+]
InChIInChI=1S/C5H9NO4S.K.H/c1-4(2)5(7)6-3-11(8,9)10;;/h1,3H2,2H3,(H,6,7)(H,8,9,10);;/q;+1;-1
InChIKeySEJYOYJHDVPSRV-UHFFFAOYSA-N
XLogP-3.36
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 5-3.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid?
The IUPAC name of potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid (CID 173360160) is potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid.
What is the SMILES notation for potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid?
The canonical SMILES for potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid is C=C(C)C(=O)NCS(=O)(=O)O.[H-].[K+].
What is the InChIKey of potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid?
The InChIKey is SEJYOYJHDVPSRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO4S.K.H/c1-4(2)5(7)6-3-11(8,9)10;;/h1,3H2,2H3,(H,6,7)(H,8,9,10);;/q;+1;-1.
What are the key properties of potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid?
potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid has a molecular weight of 219.30 g/mol, XLogP of -3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;(2-methylprop-2-enoylamino)methanesulfonic acid is sourced from PubChem (CID 173360160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).