N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide

C10H14FNO3S — CID 73168425

IUPACN-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide
SMILESCOC(CNS(C)(=O)=O)c1cccc(F)c1
InChIInChI=1S/C10H14FNO3S/c1-15-10(7-12-16(2,13)14)8-4-3-5-9(11)6-8/h3-6,10,12H,7H2,1-2H3
InChIKeyFHOROSDKNOLUDH-UHFFFAOYSA-N
MW247.29 g/mol
LogP1.06
Rot. Bonds5

About N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide

N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide (PubChem CID 73168425) has the molecular formula C10H14FNO3S and a molecular weight of 247.29 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide
PubChem CID73168425
Molecular FormulaC10H14FNO3S
Molecular Weight247.29 g/mol
Exact Mass247.07
IUPAC NameN-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide
SMILESCOC(CNS(C)(=O)=O)c1cccc(F)c1
InChIInChI=1S/C10H14FNO3S/c1-15-10(7-12-16(2,13)14)8-4-3-5-9(11)6-8/h3-6,10,12H,7H2,1-2H3
InChIKeyFHOROSDKNOLUDH-UHFFFAOYSA-N
XLogP1.06
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide?
The IUPAC name of N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide (CID 73168425) is N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide?
The canonical SMILES for N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide is COC(CNS(C)(=O)=O)c1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide?
The InChIKey is FHOROSDKNOLUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO3S/c1-15-10(7-12-16(2,13)14)8-4-3-5-9(11)6-8/h3-6,10,12H,7H2,1-2H3.
What are the key properties of N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide?
N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide has a molecular weight of 247.29 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-2-methoxyethyl]methanesulfonamide is sourced from PubChem (CID 73168425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).