1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide

C10H14FNO2S — CID 14879139

IUPAC1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)NS(=O)(=O)Cc1ccccc1F
InChIInChI=1S/C10H14FNO2S/c1-8(2)12-15(13,14)7-9-5-3-4-6-10(9)11/h3-6,8,12H,7H2,1-2H3
InChIKeyUIBJCEXDXHTUCE-UHFFFAOYSA-N
MW231.29 g/mol
LogP1.65
Rot. Bonds4

About 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide

1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide (PubChem CID 14879139) has the molecular formula C10H14FNO2S and a molecular weight of 231.29 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide
PubChem CID14879139
Molecular FormulaC10H14FNO2S
Molecular Weight231.29 g/mol
Exact Mass231.07
IUPAC Name1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)NS(=O)(=O)Cc1ccccc1F
InChIInChI=1S/C10H14FNO2S/c1-8(2)12-15(13,14)7-9-5-3-4-6-10(9)11/h3-6,8,12H,7H2,1-2H3
InChIKeyUIBJCEXDXHTUCE-UHFFFAOYSA-N
XLogP1.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-methylbenzene-1-sulfonamide
CID 4190095
N-Phenethylmethanesulfonamide
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4-methyl-N-pentan-2-ylbenzenesulfonamide
CID 3703019
N-(1-Phenylethyl)methanesulfonamide
CID 380740
N-methyl-1-phenylmethanesulfonamide
CID 290582
N-[2-(4-fluorophenyl)ethyl]-1-phenylmethanesulfonamide
CID 807610
N-(4-phenylbutyl)ethanesulfonamide
CID 2179616
N-(3-phenylpropyl)ethanesulfonamide
CID 2167095
N-[2-(benzylsulfanyl)ethyl]methanesulfonamide
CID 2197817
N-Methyl-2-phenylethene-1-sulfonamide
CID 2427246
(+,-) Cis-Propane-2-sulfonic Acid [2-(3-fluoro-phenyl)-cyclopentyl]-amide
CID 10935011
Fluoro(phenyl)methanesulfonamide
CID 11355950

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide?
The IUPAC name of 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide (CID 14879139) is 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide is CC(C)NS(=O)(=O)Cc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide?
The InChIKey is UIBJCEXDXHTUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO2S/c1-8(2)12-15(13,14)7-9-5-3-4-6-10(9)11/h3-6,8,12H,7H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide?
1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide has a molecular weight of 231.29 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-propan-2-ylmethanesulfonamide is sourced from PubChem (CID 14879139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).