4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide

C7H9F3N2O2S2 — CID 63226058

IUPAC4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)NCCC(F)(F)F)c1
InChIInChI=1S/C7H9F3N2O2S2/c8-7(9,10)1-2-12-16(13,14)6-3-5(11)4-15-6/h3-4,12H,1-2,11H2
InChIKeyLIZXATPAOFJGPU-UHFFFAOYSA-N
MW274.29 g/mol
LogP1.56
Rot. Bonds4

About 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide

4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide (PubChem CID 63226058) has the molecular formula C7H9F3N2O2S2 and a molecular weight of 274.29 g/mol. Its IUPAC name is 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide
PubChem CID63226058
Molecular FormulaC7H9F3N2O2S2
Molecular Weight274.29 g/mol
Exact Mass274.01
IUPAC Name4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)NCCC(F)(F)F)c1
InChIInChI=1S/C7H9F3N2O2S2/c8-7(9,10)1-2-12-16(13,14)6-3-5(11)4-15-6/h3-4,12H,1-2,11H2
InChIKeyLIZXATPAOFJGPU-UHFFFAOYSA-N
XLogP1.56
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.29
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[2-(trifluoromethylsulfanyl)ethyl]thiophene-2-sulfonamide
CID 106425735
4-amino-N-[2-(methanesulfonamido)ethyl]thiophene-2-sulfonamide
CID 61299780
4-amino-N-(2,2-difluoro-3-hydroxypropyl)thiophene-2-sulfonamide
CID 106165593
4-amino-N-(2-methoxyethyl)thiophene-2-sulfonamide
CID 61301299
4-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]thiophene-2-sulfonamide
CID 114132852
4-amino-N-(2-pyridin-4-ylethyl)thiophene-2-sulfonamide
CID 61299000
4-amino-N-(2-thiophen-3-ylethyl)thiophene-2-sulfonamide
CID 54953251
4-amino-N-(2-butoxyethyl)thiophene-2-sulfonamide
CID 61301356
5-(5,5,5-trifluoropentylsulfamoyl)thiophene-3-carboxylic acid
CID 115515900
4-amino-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]thiophene-2-sulfonamide
CID 64518781
4-amino-N-[2-(oxolan-2-yl)ethyl]thiophene-2-sulfonamide
CID 61300388
4-amino-N-(2-pyridin-3-ylethyl)thiophene-2-sulfonamide
CID 61298806

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide (CID 63226058) is 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide is Nc1csc(S(=O)(=O)NCCC(F)(F)F)c1.
What is the InChIKey of 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide?
The InChIKey is LIZXATPAOFJGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2O2S2/c8-7(9,10)1-2-12-16(13,14)6-3-5(11)4-15-6/h3-4,12H,1-2,11H2.
What are the key properties of 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide?
4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide has a molecular weight of 274.29 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 63226058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).