CID 118692694

C5H6KN2O2S — CID 118692694

IUPAC—
SMILESNS(=O)(=O)c1cccnc1.[K]
InChIInChI=1S/C5H6N2O2S.K/c6-10(8,9)5-2-1-3-7-4-5;/h1-4H,(H2,6,8,9);
InChIKeyJPEFXLALDFWCHO-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.65
Rot. Bonds1

About CID 118692694

CID 118692694 (PubChem CID 118692694) has the molecular formula C5H6KN2O2S and a molecular weight of 197.28 g/mol.

Molecular Properties

Compound NameCID 118692694
PubChem CID118692694
Molecular FormulaC5H6KN2O2S
Molecular Weight197.28 g/mol
Exact Mass196.98
IUPAC Name—
SMILESNS(=O)(=O)c1cccnc1.[K]
InChIInChI=1S/C5H6N2O2S.K/c6-10(8,9)5-2-1-3-7-4-5;/h1-4H,(H2,6,8,9);
InChIKeyJPEFXLALDFWCHO-UHFFFAOYSA-N
XLogP-0.65
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

pyridine-3-sulfonamide;hydrochloride
CID 67156649
calcium bis(pyridine-3-sulfonate)
CID 87775779
3-(benzenesulfonyl)pyridine
CID 5147032
pyridin-3-yl sulfamate
CID 130625844
3-(difluoromethylsulfonyl)pyridine
CID 75530035
3-(1-pyridin-3-ylethylamino)benzenesulfonamide
CID 43193566
4-(pyridin-3-ylmethylideneamino)benzenesulfonamide
CID 10659069
3-aminobenzenesulfonamide;isoquinoline
CID 161089636
N-pyridin-3-yl-3-sulfamoylbenzamide
CID 164627954
N-(4-methyl-3-sulfamoylphenyl)pyridine-3-sulfonamide
CID 61131422
N-(2-amino-2-methylpropyl)pyridine-3-sulfonamide
CID 115303456
3-(2-methylpropylsulfonyl)pyridine
CID 166834776

Frequently Asked Questions

What is the IUPAC name of CID 118692694?
The IUPAC name of CID 118692694 (CID 118692694) is not available.
What is the SMILES notation for CID 118692694?
The canonical SMILES for CID 118692694 is NS(=O)(=O)c1cccnc1.[K].
What is the InChIKey of CID 118692694?
The InChIKey is JPEFXLALDFWCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2S.K/c6-10(8,9)5-2-1-3-7-4-5;/h1-4H,(H2,6,8,9);.
What are the key properties of CID 118692694?
CID 118692694 has a molecular weight of 197.28 g/mol, XLogP of -0.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 118692694 is sourced from PubChem (CID 118692694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).