potassium;amino(oxo)methanesulfonic acid;hydride

CH4KNO4S — CID 173000398

IUPACpotassium;amino(oxo)methanesulfonic acid;hydride
SMILESNC(=O)S(=O)(=O)O.[H-].[K+]
InChIInChI=1S/CH3NO4S.K.H/c2-1(3)7(4,5)6;;/h(H2,2,3)(H,4,5,6);;/q;+1;-1
InChIKeyHAMCQNIEYZBPIG-UHFFFAOYSA-N
MW165.21 g/mol
LogP-3.93
Rot. Bonds

About potassium;amino(oxo)methanesulfonic acid;hydride

potassium;amino(oxo)methanesulfonic acid;hydride (PubChem CID 173000398) has the molecular formula CH4KNO4S and a molecular weight of 165.21 g/mol. Its IUPAC name is potassium;amino(oxo)methanesulfonic acid;hydride.

Molecular Properties

Compound Namepotassium;amino(oxo)methanesulfonic acid;hydride
PubChem CID173000398
Molecular FormulaCH4KNO4S
Molecular Weight165.21 g/mol
Exact Mass164.95
IUPAC Namepotassium;amino(oxo)methanesulfonic acid;hydride
SMILESNC(=O)S(=O)(=O)O.[H-].[K+]
InChIInChI=1S/CH3NO4S.K.H/c2-1(3)7(4,5)6;;/h(H2,2,3)(H,4,5,6);;/q;+1;-1
InChIKeyHAMCQNIEYZBPIG-UHFFFAOYSA-N
XLogP-3.93
TPSA97.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 5-3.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 173220382
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Frequently Asked Questions

What is the IUPAC name of potassium;amino(oxo)methanesulfonic acid;hydride?
The IUPAC name of potassium;amino(oxo)methanesulfonic acid;hydride (CID 173000398) is potassium;amino(oxo)methanesulfonic acid;hydride.
What is the SMILES notation for potassium;amino(oxo)methanesulfonic acid;hydride?
The canonical SMILES for potassium;amino(oxo)methanesulfonic acid;hydride is NC(=O)S(=O)(=O)O.[H-].[K+].
What is the InChIKey of potassium;amino(oxo)methanesulfonic acid;hydride?
The InChIKey is HAMCQNIEYZBPIG-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3NO4S.K.H/c2-1(3)7(4,5)6;;/h(H2,2,3)(H,4,5,6);;/q;+1;-1.
What are the key properties of potassium;amino(oxo)methanesulfonic acid;hydride?
potassium;amino(oxo)methanesulfonic acid;hydride has a molecular weight of 165.21 g/mol, XLogP of -3.93, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;amino(oxo)methanesulfonic acid;hydride is sourced from PubChem (CID 173000398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).