2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide

C16H16FNO3S — CID 86992971

IUPAC2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)C(C)S(=O)(=O)c1ccccc1F
InChIInChI=1S/C16H16FNO3S/c1-11-7-3-5-9-14(11)18-16(19)12(2)22(20,21)15-10-6-4-8-13(15)17/h3-10,12H,1-2H3,(H,18,19)
InChIKeyUZOWBEJZCDGPLW-UHFFFAOYSA-N
MW321.37 g/mol
LogP2.94
Rot. Bonds4

About 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide

2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide (PubChem CID 86992971) has the molecular formula C16H16FNO3S and a molecular weight of 321.37 g/mol. Its IUPAC name is 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide
PubChem CID86992971
Molecular FormulaC16H16FNO3S
Molecular Weight321.37 g/mol
Exact Mass321.08
IUPAC Name2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)C(C)S(=O)(=O)c1ccccc1F
InChIInChI=1S/C16H16FNO3S/c1-11-7-3-5-9-14(11)18-16(19)12(2)22(20,21)15-10-6-4-8-13(15)17/h3-10,12H,1-2H3,(H,18,19)
InChIKeyUZOWBEJZCDGPLW-UHFFFAOYSA-N
XLogP2.94
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclohexyl-2-(2-fluorophenyl)sulfonylpropanamide
CID 94151255
2-(3-aminopropylsulfonyl)-N-(2-methylphenyl)propanamide
CID 82180098
N-(2,5-difluorophenyl)-2-(2,5-difluorophenyl)sulfonylpropanamide
CID 42962648
2-chloro-N-(2-methylphenyl)propanamide
CID 3858908
(2S)-2-(4-fluoro-N-methylsulfonylanilino)-N-(2-methylphenyl)propanamide
CID 124561242
2-amino-N-(2-methylphenyl)propanamide;hydrochloride
CID 56832187
(2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(4-iodo-2-methylphenyl)-3-methylbutanamide
CID 55937923
3-methyl-N-(2-methylphenyl)-2-sulfanylbutanamide
CID 107021666
2,3-dimethyl-4-(2-methylanilino)-4-oxobutanoic acid;methane
CID 158872294
N-(5-fluoro-2-methylphenyl)-2-[(2-methylphenyl)methylsulfonyl]propanamide
CID 86923009
2-(2-hydroxyethylamino)-N-(2-methylphenyl)propanamide
CID 82358477
2-(2,6-difluoroanilino)-N-(2-methylphenyl)acetamide
CID 28879023

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide?
The IUPAC name of 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide (CID 86992971) is 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide.
What is the SMILES notation for 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide?
The canonical SMILES for 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide is Cc1ccccc1NC(=O)C(C)S(=O)(=O)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide?
The InChIKey is UZOWBEJZCDGPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO3S/c1-11-7-3-5-9-14(11)18-16(19)12(2)22(20,21)15-10-6-4-8-13(15)17/h3-10,12H,1-2H3,(H,18,19).
What are the key properties of 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide?
2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide has a molecular weight of 321.37 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)sulfonyl-N-(2-methylphenyl)propanamide is sourced from PubChem (CID 86992971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).