2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide

C9H11F3N2O3S2 — CID 65386753

IUPAC2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESNS(=O)(=O)c1ccc(CC(=O)NCCC(F)(F)F)s1
InChIInChI=1S/C9H11F3N2O3S2/c10-9(11,12)3-4-14-7(15)5-6-1-2-8(18-6)19(13,16)17/h1-2H,3-5H2,(H,14,15)(H2,13,16,17)
InChIKeyGRPQRILRZZNTKP-UHFFFAOYSA-N
MW316.33 g/mol
LogP1.01
Rot. Bonds5

About 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide

2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide (PubChem CID 65386753) has the molecular formula C9H11F3N2O3S2 and a molecular weight of 316.33 g/mol. Its IUPAC name is 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide.

Molecular Properties

Compound Name2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide
PubChem CID65386753
Molecular FormulaC9H11F3N2O3S2
Molecular Weight316.33 g/mol
Exact Mass316.02
IUPAC Name2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESNS(=O)(=O)c1ccc(CC(=O)NCCC(F)(F)F)s1
InChIInChI=1S/C9H11F3N2O3S2/c10-9(11,12)3-4-14-7(15)5-6-1-2-8(18-6)19(13,16)17/h1-2H,3-5H2,(H,14,15)(H2,13,16,17)
InChIKeyGRPQRILRZZNTKP-UHFFFAOYSA-N
XLogP1.01
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2,2-difluoroethoxy)ethyl]-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 103082307
N-(2,3-dimethylbutyl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 64723560
N-(2-methylbutan-2-yl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 39007502
2-(5-sulfamoylthiophen-2-yl)acetamide
CID 60758764
N-(2-hydroxyethyl)-4-[[2-(5-sulfamoylthiophen-2-yl)acetyl]amino]benzamide
CID 154845795
N-propyl-4-[[2-(5-sulfamoylthiophen-2-yl)acetyl]amino]benzamide
CID 154835109
methyl 2-(5-sulfamoylthiophen-2-yl)acetate
CID 60753569
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133898
2-acetamido-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
CID 61128464
N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 47166864
2-[4-(aminomethyl)phenyl]-N-(3,3,3-trifluoropropyl)acetamide
CID 63591393
N-[(1S)-3,3-dimethyl-1-phenylbutyl]-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 39596248

Frequently Asked Questions

What is the IUPAC name of 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The IUPAC name of 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide (CID 65386753) is 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide.
What is the SMILES notation for 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The canonical SMILES for 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide is NS(=O)(=O)c1ccc(CC(=O)NCCC(F)(F)F)s1.
What is the InChIKey of 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The InChIKey is GRPQRILRZZNTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2O3S2/c10-9(11,12)3-4-14-7(15)5-6-1-2-8(18-6)19(13,16)17/h1-2H,3-5H2,(H,14,15)(H2,13,16,17).
What are the key properties of 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide?
2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide has a molecular weight of 316.33 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-sulfamoylthiophen-2-yl)-N-(3,3,3-trifluoropropyl)acetamide is sourced from PubChem (CID 65386753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).