1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine

C14H20FNO2S — CID 104753879

IUPAC1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine
SMILESCNC(CS(=O)(=O)c1ccccc1F)C1CCCC1
InChIInChI=1S/C14H20FNO2S/c1-16-13(11-6-2-3-7-11)10-19(17,18)14-9-5-4-8-12(14)15/h4-5,8-9,11,13,16H,2-3,6-7,10H2,1H3
InChIKeyFCWFJGRDNRGIAZ-UHFFFAOYSA-N
MW285.38 g/mol
LogP2.38
Rot. Bonds5

About 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine

1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine (PubChem CID 104753879) has the molecular formula C14H20FNO2S and a molecular weight of 285.38 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine
PubChem CID104753879
Molecular FormulaC14H20FNO2S
Molecular Weight285.38 g/mol
Exact Mass285.12
IUPAC Name1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine
SMILESCNC(CS(=O)(=O)c1ccccc1F)C1CCCC1
InChIInChI=1S/C14H20FNO2S/c1-16-13(11-6-2-3-7-11)10-19(17,18)14-9-5-4-8-12(14)15/h4-5,8-9,11,13,16H,2-3,6-7,10H2,1H3
InChIKeyFCWFJGRDNRGIAZ-UHFFFAOYSA-N
XLogP2.38
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-N-methyl-2-(2-methylphenyl)sulfonylethanamine
CID 104754126
1-cyclopropyl-N-methyl-2-(2-nitrophenyl)sulfonylethanamine
CID 64646113
1-(2-fluorophenyl)sulfonyl-N-methylpentan-2-amine
CID 64645946
4-(2-fluorophenyl)sulfonyl-3-(methylamino)butan-1-ol
CID 64897786
1-cyclopentyl-2-(3,4-dimethylphenyl)sulfonyl-N-methylethanamine
CID 104753847
1-cyclopropyl-2-(2,6-dichlorophenyl)sulfonyl-N-methylethanamine
CID 64675532
N-(2-amino-1-cyclohexylethyl)-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide
CID 119589001
2-fluoro-N-[4-(methylamino)cyclohexyl]benzenesulfonamide
CID 43653542
(2S)-N-cyclohexyl-2-(2-fluorophenyl)sulfonylpropanamide
CID 94151255
2-(2-fluorophenyl)sulfonyl-N-methylcycloheptan-1-amine
CID 64645152
2-[(2-fluorophenyl)sulfonylmethyl]oxane
CID 64716675
1-(ethylamino)-3-(2-fluorophenyl)sulfonylpropan-2-ol
CID 113317924

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine?
The IUPAC name of 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine (CID 104753879) is 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine.
What is the SMILES notation for 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine?
The canonical SMILES for 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine is CNC(CS(=O)(=O)c1ccccc1F)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine?
The InChIKey is FCWFJGRDNRGIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2S/c1-16-13(11-6-2-3-7-11)10-19(17,18)14-9-5-4-8-12(14)15/h4-5,8-9,11,13,16H,2-3,6-7,10H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine?
1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine has a molecular weight of 285.38 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-fluorophenyl)sulfonyl-N-methylethanamine is sourced from PubChem (CID 104753879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).