CID 87267100

C3HF6LiNO3S — CID 87267100

IUPAC—
SMILESO=C(NS(=O)(=O)C(F)(F)F)C(F)(F)F.[Li]
InChIInChI=1S/C3HF6NO3S.Li/c4-2(5,6)1(11)10-14(12,13)3(7,8)9;/h(H,10,11);
InChIKeyCIFNOPIPROJVFE-UHFFFAOYSA-N
MW252.04 g/mol
LogP0.13
Rot. Bonds1

About CID 87267100

CID 87267100 (PubChem CID 87267100) has the molecular formula C3HF6LiNO3S and a molecular weight of 252.04 g/mol.

Molecular Properties

Compound NameCID 87267100
PubChem CID87267100
Molecular FormulaC3HF6LiNO3S
Molecular Weight252.04 g/mol
Exact Mass251.97
IUPAC Name—
SMILESO=C(NS(=O)(=O)C(F)(F)F)C(F)(F)F.[Li]
InChIInChI=1S/C3HF6NO3S.Li/c4-2(5,6)1(11)10-14(12,13)3(7,8)9;/h(H,10,11);
InChIKeyCIFNOPIPROJVFE-UHFFFAOYSA-N
XLogP0.13
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.04
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,2-trifluoro-N-(1,1,2,2,2-pentafluoroethylsulfonyl)acetamide
CID 87267309
sodium;hydride;(2,2,2-trifluoroacetyl)sulfamic acid
CID 173392621
2-(acetylsulfamoyl)-N-(trifluoromethylsulfonyl)acetamide
CID 89050003
N-[difluoro(piperidin-1-ylsulfonyl)methyl]sulfonyl-2,2,2-trifluoroacetamide
CID 88855230
1-butyl-2H-pyridine;2,2,2-trifluoro-N-(trifluoromethylsulfonyl)acetamide
CID 175716542
2-methyl-2-phenyl-N-(trifluoromethylsulfonyl)propanamide
CID 155170790
1-butyl-3-methylpyridin-1-ium;2,2,2-trifluoro-N-(trifluoromethylsulfonyl)acetamide
CID 87208294
indium(3+);bis(1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide)
CID 131725280
2,3,3,3-tetrafluoro-N-(1,1,1,2,3,3,3-heptafluoropropan-2-ylsulfonyl)-2-(trifluoromethyl)propanamide
CID 171725734
2-(acetylsulfamoyl)-2-sulfanylidene-N-(trifluoromethylsulfonyl)acetamide
CID 89050021
copper;bis(1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide)
CID 161328389
1-butyl-2,3-bis(trifluoromethylsulfonyl)pyridin-1-ium;2,2,2-trifluoro-N-(trifluoromethylsulfonyl)acetamide
CID 161255887

Frequently Asked Questions

What is the IUPAC name of CID 87267100?
The IUPAC name of CID 87267100 (CID 87267100) is not available.
What is the SMILES notation for CID 87267100?
The canonical SMILES for CID 87267100 is O=C(NS(=O)(=O)C(F)(F)F)C(F)(F)F.[Li].
What is the InChIKey of CID 87267100?
The InChIKey is CIFNOPIPROJVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HF6NO3S.Li/c4-2(5,6)1(11)10-14(12,13)3(7,8)9;/h(H,10,11);.
What are the key properties of CID 87267100?
CID 87267100 has a molecular weight of 252.04 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87267100 is sourced from PubChem (CID 87267100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).