N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide

C15H15FN2O3S2 — CID 174855973

IUPACN-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide
SMILESCN(C1CC1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2F)s1
InChIInChI=1S/C15H15FN2O3S2/c1-18(10-6-7-10)23(20,21)14-9-8-13(22-14)17-15(19)11-4-2-3-5-12(11)16/h2-5,8-10H,6-7H2,1H3,(H,17,19)
InChIKeyBHUGBLCWJOVENS-UHFFFAOYSA-N
MW354.43 g/mol
LogP2.92
Rot. Bonds5

About N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide

N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide (PubChem CID 174855973) has the molecular formula C15H15FN2O3S2 and a molecular weight of 354.43 g/mol. Its IUPAC name is N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide
PubChem CID174855973
Molecular FormulaC15H15FN2O3S2
Molecular Weight354.43 g/mol
Exact Mass354.05
IUPAC NameN-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide
SMILESCN(C1CC1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2F)s1
InChIInChI=1S/C15H15FN2O3S2/c1-18(10-6-7-10)23(20,21)14-9-8-13(22-14)17-15(19)11-4-2-3-5-12(11)16/h2-5,8-10H,6-7H2,1H3,(H,17,19)
InChIKeyBHUGBLCWJOVENS-UHFFFAOYSA-N
XLogP2.92
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide?
The IUPAC name of N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide (CID 174855973) is N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide.
What is the SMILES notation for N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide?
The canonical SMILES for N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide is CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2F)s1.
What is the InChIKey of N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide?
The InChIKey is BHUGBLCWJOVENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3S2/c1-18(10-6-7-10)23(20,21)14-9-8-13(22-14)17-15(19)11-4-2-3-5-12(11)16/h2-5,8-10H,6-7H2,1H3,(H,17,19).
What are the key properties of N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide?
N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide has a molecular weight of 354.43 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[cyclopropyl(methyl)sulfamoyl]thiophen-2-yl]-2-fluorobenzamide is sourced from PubChem (CID 174855973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).