5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide

C15H15FN2O3S — CID 34033824

IUPAC5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1C(N)=O
InChIInChI=1S/C15H15FN2O3S/c1-10-6-7-12(8-13(10)15(17)19)22(20,21)18-9-11-4-2-3-5-14(11)16/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyKUNHSXQOBLFEPU-UHFFFAOYSA-N
MW322.36 g/mol
LogP1.71
Rot. Bonds5

About 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide

5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide (PubChem CID 34033824) has the molecular formula C15H15FN2O3S and a molecular weight of 322.36 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide.

Molecular Properties

Compound Name5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide
PubChem CID34033824
Molecular FormulaC15H15FN2O3S
Molecular Weight322.36 g/mol
Exact Mass322.08
IUPAC Name5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1C(N)=O
InChIInChI=1S/C15H15FN2O3S/c1-10-6-7-12(8-13(10)15(17)19)22(20,21)18-9-11-4-2-3-5-14(11)16/h2-8,18H,9H2,1H3,(H2,17,19)
InChIKeyKUNHSXQOBLFEPU-UHFFFAOYSA-N
XLogP1.71
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[(2-fluorophenyl)methyl]-4-methylbenzenesulfonamide
CID 39620815
2-chloro-5-[(2-fluorophenyl)methylsulfamoyl]benzoic acid
CID 45411146
2-methyl-5-[(4-methylphenyl)methylsulfamoyl]benzamide
CID 3439524
5-[(3,3-difluoro-2-hydroxypropyl)sulfamoyl]-2-methylbenzamide
CID 103836901
4-amino-3-fluoro-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 82843640
5-[(2-fluorophenyl)methylsulfamoyl]-2-methoxy-N-methylbenzamide
CID 53282833
5-(ethylsulfamoyl)-N-[(2-fluorophenyl)methyl]-N,2-dimethylbenzamide
CID 31138800
N-[2-(2-fluorophenyl)ethyl]-5-(furan-2-ylmethylsulfamoyl)-2-methylbenzamide
CID 31282083
3-[(3-carbamoyl-4-methylphenyl)sulfonylamino]-2-methylpropanoic acid
CID 62675880
5-[(2,2-difluoro-3-hydroxypropyl)sulfamoyl]-2-methylbenzamide
CID 104858816
2-methyl-5-(phenylsulfamoyl)benzamide
CID 870864
2-methyl-5-(1H-pyrazol-4-ylmethylsulfamoyl)benzamide
CID 61003075

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide?
The IUPAC name of 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide (CID 34033824) is 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide.
What is the SMILES notation for 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide?
The canonical SMILES for 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide is Cc1ccc(S(=O)(=O)NCc2ccccc2F)cc1C(N)=O.
What is the InChIKey of 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide?
The InChIKey is KUNHSXQOBLFEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3S/c1-10-6-7-12(8-13(10)15(17)19)22(20,21)18-9-11-4-2-3-5-14(11)16/h2-8,18H,9H2,1H3,(H2,17,19).
What are the key properties of 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide?
5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide has a molecular weight of 322.36 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)methylsulfamoyl]-2-methylbenzamide is sourced from PubChem (CID 34033824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).