N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide

C11H16FNO3S — CID 71810659

IUPACN-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide
SMILESCOC(C)(CNS(C)(=O)=O)c1ccccc1F
InChIInChI=1S/C11H16FNO3S/c1-11(16-2,8-13-17(3,14)15)9-6-4-5-7-10(9)12/h4-7,13H,8H2,1-3H3
InChIKeyQFLVNHUFYSHKSZ-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.24
Rot. Bonds5

About N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide

N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide (PubChem CID 71810659) has the molecular formula C11H16FNO3S and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide
PubChem CID71810659
Molecular FormulaC11H16FNO3S
Molecular Weight261.32 g/mol
Exact Mass261.08
IUPAC NameN-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide
SMILESCOC(C)(CNS(C)(=O)=O)c1ccccc1F
InChIInChI=1S/C11H16FNO3S/c1-11(16-2,8-13-17(3,14)15)9-6-4-5-7-10(9)12/h4-7,13H,8H2,1-3H3
InChIKeyQFLVNHUFYSHKSZ-UHFFFAOYSA-N
XLogP1.24
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methoxy-2-phenylpropan-1-amine
CID 53276254
N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide
CID 73168425
(E)-N-(2-(3-fluorophenyl)-2-methoxyethyl)-2-phenylethenesulfonamide
CID 73168430
(R)-2-(o-fluorophenyl)-2-methoxypropylamine
CID 96681773
[(R)-2-methoxy-2-(o-tolyl)ethyl](propylsulfonyl)amine
CID 97417775
(cyclopropylsulfonyl)[(R)-2-(o-fluorophenyl)-2-methoxypropyl]amine
CID 97428434
{[p-(trifluoromethyl)phenyl]methylsulfonyl}[(R)-2-(o-fluorophenyl)-2-methoxypropyl]amine
CID 97428480
{[p-(trifluoromethyl)phenyl]methylsulfonyl}[(R)-2-methoxy-2-phenylbutyl]amine
CID 97428660
[(R)-2-(m-fluorophenyl)-2-methoxyethyl][(m-tolyl)methylsulfonyl]amine
CID 97553503
N-mesyl[(R)-2-(m-chlorophenyl)-2-methoxypropyl]amine
CID 97554040
2-Methoxy-2-phenylbutan-1-amine
CID 83828043
N-(2-cyclopropyl-2-hydroxy-2-phenylethyl)methanesulfonamide
CID 71788792

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide?
The IUPAC name of N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide (CID 71810659) is N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide?
The canonical SMILES for N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide is COC(C)(CNS(C)(=O)=O)c1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide?
The InChIKey is QFLVNHUFYSHKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO3S/c1-11(16-2,8-13-17(3,14)15)9-6-4-5-7-10(9)12/h4-7,13H,8H2,1-3H3.
What are the key properties of N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide?
N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide has a molecular weight of 261.32 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)-2-methoxypropyl]methanesulfonamide is sourced from PubChem (CID 71810659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).