N-(4-fluorophenyl)-N-methylmethanesulfonamide

C8H10FNO2S — CID 61061445

IUPACN-(4-fluorophenyl)-N-methylmethanesulfonamide
SMILESCN(c1ccc(F)cc1)S(C)(=O)=O
InChIInChI=1S/C8H10FNO2S/c1-10(13(2,11)12)8-5-3-7(9)4-6-8/h3-6H,1-2H3
InChIKeyMGFUWUDDGFTBSA-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.22
Rot. Bonds2

About N-(4-fluorophenyl)-N-methylmethanesulfonamide

N-(4-fluorophenyl)-N-methylmethanesulfonamide (PubChem CID 61061445) has the molecular formula C8H10FNO2S and a molecular weight of 203.24 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-methylmethanesulfonamide
PubChem CID61061445
Molecular FormulaC8H10FNO2S
Molecular Weight203.24 g/mol
Exact Mass203.04
IUPAC NameN-(4-fluorophenyl)-N-methylmethanesulfonamide
SMILESCN(c1ccc(F)cc1)S(C)(=O)=O
InChIInChI=1S/C8H10FNO2S/c1-10(13(2,11)12)8-5-3-7(9)4-6-8/h3-6H,1-2H3
InChIKeyMGFUWUDDGFTBSA-UHFFFAOYSA-N
XLogP1.22
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-methylmethanesulfonamide?
The IUPAC name of N-(4-fluorophenyl)-N-methylmethanesulfonamide (CID 61061445) is N-(4-fluorophenyl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(4-fluorophenyl)-N-methylmethanesulfonamide is CN(c1ccc(F)cc1)S(C)(=O)=O.
What is the InChIKey of N-(4-fluorophenyl)-N-methylmethanesulfonamide?
The InChIKey is MGFUWUDDGFTBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2S/c1-10(13(2,11)12)8-5-3-7(9)4-6-8/h3-6H,1-2H3.
What are the key properties of N-(4-fluorophenyl)-N-methylmethanesulfonamide?
N-(4-fluorophenyl)-N-methylmethanesulfonamide has a molecular weight of 203.24 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 61061445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).