N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide

C14H14FNO2S — CID 7034179

IUPACN-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1ccccc1F
InChIInChI=1S/C14H14FNO2S/c15-14-9-5-4-8-13(14)10-16-19(17,18)11-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKeyYLOIVYNCWJIOLF-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.45
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide

N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide (PubChem CID 7034179) has the molecular formula C14H14FNO2S and a molecular weight of 279.34 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide
PubChem CID7034179
Molecular FormulaC14H14FNO2S
Molecular Weight279.34 g/mol
Exact Mass279.07
IUPAC NameN-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NCc1ccccc1F
InChIInChI=1S/C14H14FNO2S/c15-14-9-5-4-8-13(14)10-16-19(17,18)11-12-6-2-1-3-7-12/h1-9,16H,10-11H2
InChIKeyYLOIVYNCWJIOLF-UHFFFAOYSA-N
XLogP2.45
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-N-[(3,4,5-trifluorophenyl)methyl]methanesulfonamide
CID 3761631
N-(2-fluorophenyl)-1-phenylmethanesulfonamide
CID 669256
1-[4-[(2-fluorophenyl)methylamino]phenyl]-N-prop-2-enylmethanesulfonamide
CID 84591032
1-(1,2-benzoxazol-3-yl)-N-[(2-fluorophenyl)methyl]methanesulfonamide
CID 90624629
N-[(2-methoxy-3-pyridinyl)methyl]-1-phenylmethanesulfonamide
CID 35389696
1-(4-chlorophenyl)-N-[(2,5-difluorophenyl)methyl]methanesulfonamide
CID 110780997
N-[(2-fluorophenyl)methyl]-2-(2-methoxyethoxy)ethanesulfonamide
CID 110409686
1-phenyl-N-(pyridin-4-ylmethyl)methanesulfonamide
CID 669282
1-phenyl-N-(quinolin-4-ylmethyl)methanesulfonamide
CID 110734278
N-[4-chloro-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-1-phenylmethanesulfonamide
CID 39853499
N-(bromomethyl)-1-phenylmethanesulfonamide
CID 174927038
N-[(4-amino-2-chlorophenyl)methyl]-1-phenylmethanesulfonamide
CID 75458443

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide (CID 7034179) is N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)NCc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide?
The InChIKey is YLOIVYNCWJIOLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2S/c15-14-9-5-4-8-13(14)10-16-19(17,18)11-12-6-2-1-3-7-12/h1-9,16H,10-11H2.
What are the key properties of N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide?
N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide has a molecular weight of 279.34 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-1-phenylmethanesulfonamide is sourced from PubChem (CID 7034179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).