N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide

C16H15FN2O3S — CID 17404523

IUPACN-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide
SMILESO=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(F)c1
InChIInChI=1S/C16H15FN2O3S/c17-12-4-1-3-11(9-12)16(20)18-14-5-2-6-15(10-14)23(21,22)19-13-7-8-13/h1-6,9-10,13,19H,7-8H2,(H,18,20)
InChIKeyGVRBJAGBATYGPD-UHFFFAOYSA-N
MW334.37 g/mol
LogP2.52
Rot. Bonds5

About N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide

N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide (PubChem CID 17404523) has the molecular formula C16H15FN2O3S and a molecular weight of 334.37 g/mol. Its IUPAC name is N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide
PubChem CID17404523
Molecular FormulaC16H15FN2O3S
Molecular Weight334.37 g/mol
Exact Mass334.08
IUPAC NameN-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide
SMILESO=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(F)c1
InChIInChI=1S/C16H15FN2O3S/c17-12-4-1-3-11(9-12)16(20)18-14-5-2-6-15(10-14)23(21,22)19-13-7-8-13/h1-6,9-10,13,19H,7-8H2,(H,18,20)
InChIKeyGVRBJAGBATYGPD-UHFFFAOYSA-N
XLogP2.52
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197
N-[3-(cyclopropylsulfamoyl)phenyl]-4-sulfamoylbenzamide
CID 24646340
3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide
CID 42236607
3-[[3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid
CID 1121769
3-(cyclopropylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 26718017
methyl 2-[3-[[3-(cyclopropylsulfamoyl)phenyl]carbamoyl]phenoxy]acetate
CID 55871864
3-(cyclopentylsulfamoyl)-N-[[3-[(4-fluorobenzoyl)amino]phenyl]methyl]benzamide
CID 55894287
N-(5-chloro-2-fluorophenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 94006212
3-fluoro-N-[4-[[(2S,3S)-2-hydroxyoxolan-3-yl]sulfamoyl]phenyl]benzamide
CID 141363354
N-[3-(cyclopropylsulfamoyl)phenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 38140750
3-(cyclopropylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
CID 30858539
N-[3-(cyclopropylsulfamoyl)phenyl]-4-fluoro-1-benzothiophene-2-carboxamide
CID 33310920

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide?
The IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide (CID 17404523) is N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide.
What is the SMILES notation for N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide?
The canonical SMILES for N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide is O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)c1cccc(F)c1.
What is the InChIKey of N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide?
The InChIKey is GVRBJAGBATYGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O3S/c17-12-4-1-3-11(9-12)16(20)18-14-5-2-6-15(10-14)23(21,22)19-13-7-8-13/h1-6,9-10,13,19H,7-8H2,(H,18,20).
What are the key properties of N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide?
N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide has a molecular weight of 334.37 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide is sourced from PubChem (CID 17404523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).