N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide

C16H14FN3O3S — CID 2768259

IUPACN-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccccc2c1C(=O)NS(=O)(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H14FN3O3S/c1-10-15(13-4-2-3-5-14(13)18-10)16(21)20-24(22,23)19-12-8-6-11(17)7-9-12/h2-9,18-19H,1H3,(H,20,21)
InChIKeyBYFHMMIOJAZVOT-UHFFFAOYSA-N
MW347.37 g/mol
LogP2.70
Rot. Bonds4

About N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide

N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide (PubChem CID 2768259) has the molecular formula C16H14FN3O3S and a molecular weight of 347.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide
PubChem CID2768259
Molecular FormulaC16H14FN3O3S
Molecular Weight347.37 g/mol
Exact Mass347.07
IUPAC NameN-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccccc2c1C(=O)NS(=O)(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H14FN3O3S/c1-10-15(13-4-2-3-5-14(13)18-10)16(21)20-24(22,23)19-12-8-6-11(17)7-9-12/h2-9,18-19H,1H3,(H,20,21)
InChIKeyBYFHMMIOJAZVOT-UHFFFAOYSA-N
XLogP2.70
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide (CID 2768259) is N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide is Cc1[nH]c2ccccc2c1C(=O)NS(=O)(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide?
The InChIKey is BYFHMMIOJAZVOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O3S/c1-10-15(13-4-2-3-5-14(13)18-10)16(21)20-24(22,23)19-12-8-6-11(17)7-9-12/h2-9,18-19H,1H3,(H,20,21).
What are the key properties of N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide?
N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide has a molecular weight of 347.37 g/mol, XLogP of 2.70, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)sulfamoyl]-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 2768259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).