potassium [3-(trifluoromethyl)phenyl]sulfonylazanide

C7H5F3KNO2S — CID 131721326

IUPACpotassium [3-(trifluoromethyl)phenyl]sulfonylazanide
SMILES[K+].[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C7H5F3NO2S.K/c8-7(9,10)5-2-1-3-6(4-5)14(11,12)13;/h1-4H,(H-,11,12,13);/q-1;+1
InChIKeyPONQKDRHPAZRET-UHFFFAOYSA-N
MW263.28 g/mol
LogP-0.55
Rot. Bonds1

About potassium [3-(trifluoromethyl)phenyl]sulfonylazanide

potassium [3-(trifluoromethyl)phenyl]sulfonylazanide (PubChem CID 131721326) has the molecular formula C7H5F3KNO2S and a molecular weight of 263.28 g/mol. Its IUPAC name is potassium [3-(trifluoromethyl)phenyl]sulfonylazanide.

Molecular Properties

Compound Namepotassium [3-(trifluoromethyl)phenyl]sulfonylazanide
PubChem CID131721326
Molecular FormulaC7H5F3KNO2S
Molecular Weight263.28 g/mol
Exact Mass262.96
IUPAC Namepotassium [3-(trifluoromethyl)phenyl]sulfonylazanide
SMILES[K+].[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C7H5F3NO2S.K/c8-7(9,10)5-2-1-3-6(4-5)14(11,12)13;/h1-4H,(H-,11,12,13);/q-1;+1
InChIKeyPONQKDRHPAZRET-UHFFFAOYSA-N
XLogP-0.55
TPSA57.94 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.28
LogP ≤ 5-0.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze potassium [3-(trifluoromethyl)phenyl]sulfonylazanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 70262336
CID 70262336
methanidyl-[3-(trifluoromethyl)phenyl]sulfonylazanium
CID 59280550
1-(1-chloroethylsulfonyl)-3-(trifluoromethyl)benzene
CID 140553640
N,N-diethyl-3-(trifluoromethyl)benzenesulfonamide
CID 5088839
2,2-difluoro-2-[3-(trifluoromethyl)phenyl]sulfonylacetic acid
CID 81218082
1-methyl-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine
CID 697906
[3-[3-(trifluoromethyl)phenyl]sulfonylcyclobutyl]methanamine
CID 67054689
1-(3-methoxycyclobutyl)sulfonyl-3-(trifluoromethyl)benzene
CID 67054918
N-[(2-methylpropan-2-yl)oxy]-3-(trifluoromethyl)benzenesulfonamide
CID 82724634
1-[(4-methylphenyl)methylsulfonyl]-3-(trifluoromethyl)benzene
CID 177392501
N-(cyanomethyl)-3-(trifluoromethyl)benzenesulfonamide
CID 3780840
N-[2-[bis[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]ethyl]amino]ethyl]-3-(trifluoromethyl)benzenesulfonamide
CID 11029080

Frequently Asked Questions

What is the IUPAC name of potassium [3-(trifluoromethyl)phenyl]sulfonylazanide?
The IUPAC name of potassium [3-(trifluoromethyl)phenyl]sulfonylazanide (CID 131721326) is potassium [3-(trifluoromethyl)phenyl]sulfonylazanide.
What is the SMILES notation for potassium [3-(trifluoromethyl)phenyl]sulfonylazanide?
The canonical SMILES for potassium [3-(trifluoromethyl)phenyl]sulfonylazanide is [K+].[NH-]S(=O)(=O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of potassium [3-(trifluoromethyl)phenyl]sulfonylazanide?
The InChIKey is PONQKDRHPAZRET-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3NO2S.K/c8-7(9,10)5-2-1-3-6(4-5)14(11,12)13;/h1-4H,(H-,11,12,13);/q-1;+1.
What are the key properties of potassium [3-(trifluoromethyl)phenyl]sulfonylazanide?
potassium [3-(trifluoromethyl)phenyl]sulfonylazanide has a molecular weight of 263.28 g/mol, XLogP of -0.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium [3-(trifluoromethyl)phenyl]sulfonylazanide is sourced from PubChem (CID 131721326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).