5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide

C17H25FN2O4S — CID 97335661

IUPAC5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide
SMILESCCNS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2[C@H](C)[C@H](OC)C2(C)C)c1
InChIInChI=1S/C17H25FN2O4S/c1-6-19-25(22,23)11-7-8-13(18)12(9-11)16(21)20-14-10(2)15(24-5)17(14,3)4/h7-10,14-15,19H,6H2,1-5H3,(H,20,21)/t10-,14+,15-/m0/s1
InChIKeyOZDWSCUEAPTJHQ-VQISRLSMSA-N
MW372.46 g/mol
LogP1.91
Rot. Bonds6

About 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide

5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide (PubChem CID 97335661) has the molecular formula C17H25FN2O4S and a molecular weight of 372.46 g/mol. Its IUPAC name is 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide.

Molecular Properties

Compound Name5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide
PubChem CID97335661
Molecular FormulaC17H25FN2O4S
Molecular Weight372.46 g/mol
Exact Mass372.15
IUPAC Name5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide
SMILESCCNS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2[C@H](C)[C@H](OC)C2(C)C)c1
InChIInChI=1S/C17H25FN2O4S/c1-6-19-25(22,23)11-7-8-13(18)12(9-11)16(21)20-14-10(2)15(24-5)17(14,3)4/h7-10,14-15,19H,6H2,1-5H3,(H,20,21)/t10-,14+,15-/m0/s1
InChIKeyOZDWSCUEAPTJHQ-VQISRLSMSA-N
XLogP1.91
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.46
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide with MolForge

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Related Compounds

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N-(3,4-dihydro-2H-chromen-4-yl)-5-(ethylsulfamoyl)-2-fluorobenzamide
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5-(ethylsulfamoyl)-N-(2-fluorophenyl)-2-methoxybenzamide
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5-(ethylsulfamoyl)-2-fluoro-N-[(4-methoxyphenyl)methyl]-N-methylbenzamide
CID 55913537
N-[4-[ethyl(propan-2-yl)amino]phenyl]-5-(ethylsulfamoyl)-2-fluorobenzamide
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Frequently Asked Questions

What is the IUPAC name of 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide?
The IUPAC name of 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide (CID 97335661) is 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide.
What is the SMILES notation for 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide?
The canonical SMILES for 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide is CCNS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2[C@H](C)[C@H](OC)C2(C)C)c1.
What is the InChIKey of 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide?
The InChIKey is OZDWSCUEAPTJHQ-VQISRLSMSA-N. The full InChI is InChI=1S/C17H25FN2O4S/c1-6-19-25(22,23)11-7-8-13(18)12(9-11)16(21)20-14-10(2)15(24-5)17(14,3)4/h7-10,14-15,19H,6H2,1-5H3,(H,20,21)/t10-,14+,15-/m0/s1.
What are the key properties of 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide?
5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide has a molecular weight of 372.46 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylsulfamoyl)-2-fluoro-N-[(1R,3S,4S)-3-methoxy-2,2,4-trimethylcyclobutyl]benzamide is sourced from PubChem (CID 97335661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).