3-fluoropropane-1-sulfonamide

C3H8FNO2S — CID 53404000

IUPAC3-fluoropropane-1-sulfonamide
SMILESNS(=O)(=O)CCCF
InChIInChI=1S/C3H8FNO2S/c4-2-1-3-8(5,6)7/h1-3H2,(H2,5,6,7)
InChIKeyTUWLBHMNJWOAQE-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.37
Rot. Bonds3

About 3-fluoropropane-1-sulfonamide

3-fluoropropane-1-sulfonamide (PubChem CID 53404000) has the molecular formula C3H8FNO2S and a molecular weight of 141.17 g/mol. Its IUPAC name is 3-fluoropropane-1-sulfonamide.

Molecular Properties

Compound Name3-fluoropropane-1-sulfonamide
PubChem CID53404000
Molecular FormulaC3H8FNO2S
Molecular Weight141.17 g/mol
Exact Mass141.03
IUPAC Name3-fluoropropane-1-sulfonamide
SMILESNS(=O)(=O)CCCF
InChIInChI=1S/C3H8FNO2S/c4-2-1-3-8(5,6)7/h1-3H2,(H2,5,6,7)
InChIKeyTUWLBHMNJWOAQE-UHFFFAOYSA-N
XLogP-0.37
TPSA60.16 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 ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Propane-2-sulfonamide
CID 3549191
Propane-1-sulphonamide
CID 3401849
3,3,3-Trifluoropropane-1-sulfonamide
CID 45790444
4,4,4-Trifluorobutane-1-sulfonamide
CID 22725686
4-Fluorobutane-1-sulfonamide
CID 53964049
5-Fluoropentane-1-sulfonamide
CID 90989561
Fluorobutane sulfonamide
CID 87704648
1,1,1-Trifluoropropane-2-sulfonamide
CID 71758664
3,3-Difluorobutane-1-sulfonamide
CID 130657266
3-Fluorocyclobutane-1-sulfonamide
CID 165753471
2,3-Difluorocyclopropane-1-sulfonamide
CID 18457682
2,2,3,3-Tetrafluoropropane-1-sulfonamide
CID 19370936

Frequently Asked Questions

What is the IUPAC name of 3-fluoropropane-1-sulfonamide?
The IUPAC name of 3-fluoropropane-1-sulfonamide (CID 53404000) is 3-fluoropropane-1-sulfonamide.
What is the SMILES notation for 3-fluoropropane-1-sulfonamide?
The canonical SMILES for 3-fluoropropane-1-sulfonamide is NS(=O)(=O)CCCF.
What is the InChIKey of 3-fluoropropane-1-sulfonamide?
The InChIKey is TUWLBHMNJWOAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8FNO2S/c4-2-1-3-8(5,6)7/h1-3H2,(H2,5,6,7).
What are the key properties of 3-fluoropropane-1-sulfonamide?
3-fluoropropane-1-sulfonamide has a molecular weight of 141.17 g/mol, XLogP of -0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoropropane-1-sulfonamide is sourced from PubChem (CID 53404000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).