N-ethyl-1-fluoromethanesulfonamide

C3H8FNO2S — CID 89091332

IUPACN-ethyl-1-fluoromethanesulfonamide
SMILESCCNS(=O)(=O)CF
InChIInChI=1S/C3H8FNO2S/c1-2-5-8(6,7)3-4/h5H,2-3H2,1H3
InChIKeyOCQIFCRZARPSJF-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.15
Rot. Bonds3

About N-ethyl-1-fluoromethanesulfonamide

N-ethyl-1-fluoromethanesulfonamide (PubChem CID 89091332) has the molecular formula C3H8FNO2S and a molecular weight of 141.17 g/mol. Its IUPAC name is N-ethyl-1-fluoromethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-1-fluoromethanesulfonamide
PubChem CID89091332
Molecular FormulaC3H8FNO2S
Molecular Weight141.17 g/mol
Exact Mass141.03
IUPAC NameN-ethyl-1-fluoromethanesulfonamide
SMILESCCNS(=O)(=O)CF
InChIInChI=1S/C3H8FNO2S/c1-2-5-8(6,7)3-4/h5H,2-3H2,1H3
InChIKeyOCQIFCRZARPSJF-UHFFFAOYSA-N
XLogP-0.15
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-fluoromethanesulfonamide?
The IUPAC name of N-ethyl-1-fluoromethanesulfonamide (CID 89091332) is N-ethyl-1-fluoromethanesulfonamide.
What is the SMILES notation for N-ethyl-1-fluoromethanesulfonamide?
The canonical SMILES for N-ethyl-1-fluoromethanesulfonamide is CCNS(=O)(=O)CF.
What is the InChIKey of N-ethyl-1-fluoromethanesulfonamide?
The InChIKey is OCQIFCRZARPSJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FNO2S/c1-2-5-8(6,7)3-4/h5H,2-3H2,1H3.
What are the key properties of N-ethyl-1-fluoromethanesulfonamide?
N-ethyl-1-fluoromethanesulfonamide has a molecular weight of 141.17 g/mol, XLogP of -0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-fluoromethanesulfonamide is sourced from PubChem (CID 89091332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).