6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole

C14H19FN2O2S — CID 103498259

IUPAC6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole
SMILESO=S(=O)(CC1CCCCN1)N1CCc2ccc(F)cc21
InChIInChI=1S/C14H19FN2O2S/c15-12-5-4-11-6-8-17(14(11)9-12)20(18,19)10-13-3-1-2-7-16-13/h4-5,9,13,16H,1-3,6-8,10H2
InChIKeyWZKYXDYLAPOPDK-UHFFFAOYSA-N
MW298.38 g/mol
LogP1.66
Rot. Bonds3

About 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole

6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole (PubChem CID 103498259) has the molecular formula C14H19FN2O2S and a molecular weight of 298.38 g/mol. Its IUPAC name is 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole.

Molecular Properties

Compound Name6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole
PubChem CID103498259
Molecular FormulaC14H19FN2O2S
Molecular Weight298.38 g/mol
Exact Mass298.12
IUPAC Name6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole
SMILESO=S(=O)(CC1CCCCN1)N1CCc2ccc(F)cc21
InChIInChI=1S/C14H19FN2O2S/c15-12-5-4-11-6-8-17(14(11)9-12)20(18,19)10-13-3-1-2-7-16-13/h4-5,9,13,16H,1-3,6-8,10H2
InChIKeyWZKYXDYLAPOPDK-UHFFFAOYSA-N
XLogP1.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole with MolForge

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

Launch Full Analysis

Related Compounds

2-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]ethanamine
CID 103495195
3-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]-N-methylpropan-1-amine
CID 103504259
1-(3-chloro-2-methylpropyl)sulfonyl-6-fluoro-2,3-dihydroindole
CID 113249349
1-ethylsulfonyl-5-fluoro-2,3-dihydroindole
CID 110713992
4-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]-N-propan-2-ylbutan-1-amine
CID 103504260
(6-fluoro-2,3-dihydroindol-1-yl)-pyrrolidin-2-ylmethanone
CID 113235710
2,5-difluoro-N-(piperidin-2-ylmethyl)benzenesulfonamide
CID 43344425
1-(piperidin-2-ylmethylsulfonyl)piperidine
CID 55151116
6-fluoro-1-(2-piperidin-2-ylethyl)-3,4-dihydroquinolin-2-one
CID 61345345
1-(azepan-3-yl)-6-fluoro-2,3-dihydroindole
CID 103503437
[4-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]phenyl]methanamine
CID 103495192
2-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]butan-1-amine
CID 103495190

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole?
The IUPAC name of 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole (CID 103498259) is 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole.
What is the SMILES notation for 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole?
The canonical SMILES for 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole is O=S(=O)(CC1CCCCN1)N1CCc2ccc(F)cc21.
What is the InChIKey of 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole?
The InChIKey is WZKYXDYLAPOPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2S/c15-12-5-4-11-6-8-17(14(11)9-12)20(18,19)10-13-3-1-2-7-16-13/h4-5,9,13,16H,1-3,6-8,10H2.
What are the key properties of 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole?
6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole has a molecular weight of 298.38 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-(piperidin-2-ylmethylsulfonyl)-2,3-dihydroindole is sourced from PubChem (CID 103498259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).