2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide

C16H15FN2O4S2 — CID 71859514

IUPAC2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide
SMILESCc1ccc(C2CC2C(=O)NS(=O)(=O)c2ccc(F)c(C(N)=O)c2)s1
InChIInChI=1S/C16H15FN2O4S2/c1-8-2-5-14(24-8)10-7-11(10)16(21)19-25(22,23)9-3-4-13(17)12(6-9)15(18)20/h2-6,10-11H,7H2,1H3,(H2,18,20)(H,19,21)
InChIKeyDZGMETZFTYNTKL-UHFFFAOYSA-N
MW382.44 g/mol
LogP1.90
Rot. Bonds5

About 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide

2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide (PubChem CID 71859514) has the molecular formula C16H15FN2O4S2 and a molecular weight of 382.44 g/mol. Its IUPAC name is 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide
PubChem CID71859514
Molecular FormulaC16H15FN2O4S2
Molecular Weight382.44 g/mol
Exact Mass382.05
IUPAC Name2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide
SMILESCc1ccc(C2CC2C(=O)NS(=O)(=O)c2ccc(F)c(C(N)=O)c2)s1
InChIInChI=1S/C16H15FN2O4S2/c1-8-2-5-14(24-8)10-7-11(10)16(21)19-25(22,23)9-3-4-13(17)12(6-9)15(18)20/h2-6,10-11H,7H2,1H3,(H2,18,20)(H,19,21)
InChIKeyDZGMETZFTYNTKL-UHFFFAOYSA-N
XLogP1.90
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-3-[[(1R,2S)-2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]amino]benzamide
CID 95289764
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 56796477
N-[1-(4-chlorophenyl)-2-hydroxyethyl]-2-(5-methylthiophen-2-yl)cyclopropane-1-carboxamide
CID 110004375
2-fluoro-5-[[1-(fluoromethyl)cyclopropyl]sulfamoyl]benzamide
CID 169187237
cis-(1R,2S)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(5-methylthiophen-2-yl)cyclopropane-1-carboxamide
CID 97071554
5-[(1-ethynylcyclopropyl)sulfamoyl]-2-fluorobenzamide
CID 169187126
5-(azetidin-3-ylsulfamoyl)-2-methylbenzamide
CID 66186326
trans-(1S,2S)-N-(4-fluorophenyl)sulfonyl-2-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 95326959
5-[(6-fluoro-3-pyridinyl)sulfamoyl]-2-methylbenzamide
CID 103775627
5-[1-(3,4-difluorophenyl)ethylsulfamoyl]-2-methylbenzamide
CID 46406560
2-fluoro-5-[1-(5-methylthiophen-2-yl)ethylamino]benzamide
CID 43705343
2-fluoro-5-[(4,4,4-trifluoro-3-phenylbutanoyl)sulfamoyl]benzamide
CID 71859517

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide?
The IUPAC name of 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide (CID 71859514) is 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide.
What is the SMILES notation for 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide?
The canonical SMILES for 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide is Cc1ccc(C2CC2C(=O)NS(=O)(=O)c2ccc(F)c(C(N)=O)c2)s1.
What is the InChIKey of 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide?
The InChIKey is DZGMETZFTYNTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O4S2/c1-8-2-5-14(24-8)10-7-11(10)16(21)19-25(22,23)9-3-4-13(17)12(6-9)15(18)20/h2-6,10-11H,7H2,1H3,(H2,18,20)(H,19,21).
What are the key properties of 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide?
2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide has a molecular weight of 382.44 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[[2-(5-methylthiophen-2-yl)cyclopropanecarbonyl]sulfamoyl]benzamide is sourced from PubChem (CID 71859514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).