N-(2-fluorophenyl)-1-phenylmethanesulfonamide

C13H12FNO2S — CID 669256

IUPACN-(2-fluorophenyl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)Nc1ccccc1F
InChIInChI=1S/C13H12FNO2S/c14-12-8-4-5-9-13(12)15-18(16,17)10-11-6-2-1-3-7-11/h1-9,15H,10H2
InChIKeyHTUNUIUXOKJZQP-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.77
Rot. Bonds4

About N-(2-fluorophenyl)-1-phenylmethanesulfonamide

N-(2-fluorophenyl)-1-phenylmethanesulfonamide (PubChem CID 669256) has the molecular formula C13H12FNO2S and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1-phenylmethanesulfonamide
PubChem CID669256
Molecular FormulaC13H12FNO2S
Molecular Weight265.31 g/mol
Exact Mass265.06
IUPAC NameN-(2-fluorophenyl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)Nc1ccccc1F
InChIInChI=1S/C13H12FNO2S/c14-12-8-4-5-9-13(12)15-18(16,17)10-11-6-2-1-3-7-11/h1-9,15H,10H2
InChIKeyHTUNUIUXOKJZQP-UHFFFAOYSA-N
XLogP2.77
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(aminomethyl)phenyl]-N-(2-fluorophenyl)methanesulfonamide
CID 29291585
1-(4-cyanophenyl)-N-(2-fluorophenyl)methanesulfonamide
CID 29298688
N-(3,4-difluoro-2-hydroxyphenyl)-1-phenylmethanesulfonamide
CID 69009630
N-(2-benzylphenyl)-1-phenylmethanesulfonamide
CID 8514129
N-(2,3,4,5,6-pentafluorophenyl)-1-phenylmethanesulfonamide
CID 17374357
N-(2-fluorophenyl)propane-1-sulfonamide
CID 60640812
N-(5-ethyl-2-fluoro-4-methylphenyl)-1-phenylmethanesulfonamide
CID 170149320
N-(5-bromo-4-fluoro-2-methylphenyl)-1-phenylmethanesulfonamide
CID 107592640
N-(2-bromo-4-fluorophenyl)-1-phenylmethanesulfonamide
CID 28939221
N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide
CID 7034179
1-(4-chlorophenyl)-N-(2-methylsulfanylphenyl)methanesulfonamide
CID 18891408
N-[2-(ethylaminomethyl)phenyl]-1-phenylmethanesulfonamide
CID 43606467

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(2-fluorophenyl)-1-phenylmethanesulfonamide (CID 669256) is N-(2-fluorophenyl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(2-fluorophenyl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(2-fluorophenyl)-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-1-phenylmethanesulfonamide?
The InChIKey is HTUNUIUXOKJZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2S/c14-12-8-4-5-9-13(12)15-18(16,17)10-11-6-2-1-3-7-11/h1-9,15H,10H2.
What are the key properties of N-(2-fluorophenyl)-1-phenylmethanesulfonamide?
N-(2-fluorophenyl)-1-phenylmethanesulfonamide has a molecular weight of 265.31 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 669256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).