(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide

C16H23FN2O3S — CID 97214709

IUPAC(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide
SMILESO=S(=O)(NC1CCN(Cc2ccccc2F)CC1)[C@H]1CCOC1
InChIInChI=1S/C16H23FN2O3S/c17-16-4-2-1-3-13(16)11-19-8-5-14(6-9-19)18-23(20,21)15-7-10-22-12-15/h1-4,14-15,18H,5-12H2/t15-/m0/s1
InChIKeyCYQOQAHVIIDJHT-HNNXBMFYSA-N
MW342.44 g/mol
LogP1.50
Rot. Bonds5

About (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide

(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide (PubChem CID 97214709) has the molecular formula C16H23FN2O3S and a molecular weight of 342.44 g/mol. Its IUPAC name is (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide.

Molecular Properties

Compound Name(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide
PubChem CID97214709
Molecular FormulaC16H23FN2O3S
Molecular Weight342.44 g/mol
Exact Mass342.14
IUPAC Name(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide
SMILESO=S(=O)(NC1CCN(Cc2ccccc2F)CC1)[C@H]1CCOC1
InChIInChI=1S/C16H23FN2O3S/c17-16-4-2-1-3-13(16)11-19-8-5-14(6-9-19)18-23(20,21)15-7-10-22-12-15/h1-4,14-15,18H,5-12H2/t15-/m0/s1
InChIKeyCYQOQAHVIIDJHT-HNNXBMFYSA-N
XLogP1.50
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide 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

N-{[1-(3,4-difluorobenzyl)piperidin-3-yl]methyl}-1-phenylmethanesulfonamide
CID 16189447
2-[4-[2-[(4-Fluorophenyl)methyl]-1,1-dioxo-1,2-thiazolidin-4-yl]piperazin-1-yl]ethanol
CID 51360635
N-[(4-fluorophenyl)methyl]-2-morpholin-4-ylethanesulfonamide
CID 76332110
N-[(1-benzylpiperidin-4-yl)methyl]-1-(2-fluorophenyl)methanesulfonamide
CID 16887830
N-(2-(4-fluorophenyl)-2-morpholinoethyl)-2-phenylethanesulfonamide
CID 18589484
2-[(4-Fluorophenyl)methyl]-4-piperidin-1-yl-1,2-thiazolidine 1,1-dioxide
CID 51360644
N-{[1-(2-fluorobenzyl)piperidin-3-yl]methyl}cyclopropanesulfonamide
CID 56739718
N-{2-[4-(2-fluorobenzyl)morpholin-2-yl]ethyl}methanesulfonamide
CID 56756954
N-benzyl-2-morpholin-4-ylethanesulfonamide
CID 76324865
US20250115569, Example 20
CID 169931829
N-(1-benzylpiperidin-4-yl)ethanesulfonamide
CID 2422964
N-((1-cyclopentylpiperidin-4-yl)methyl)-1-(2-fluorophenyl)methanesulfonamide
CID 16887755

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide?
The IUPAC name of (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide (CID 97214709) is (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide.
What is the SMILES notation for (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide?
The canonical SMILES for (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide is O=S(=O)(NC1CCN(Cc2ccccc2F)CC1)[C@H]1CCOC1.
What is the InChIKey of (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide?
The InChIKey is CYQOQAHVIIDJHT-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H23FN2O3S/c17-16-4-2-1-3-13(16)11-19-8-5-14(6-9-19)18-23(20,21)15-7-10-22-12-15/h1-4,14-15,18H,5-12H2/t15-/m0/s1.
What are the key properties of (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide?
(3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide has a molecular weight of 342.44 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]oxolane-3-sulfonamide is sourced from PubChem (CID 97214709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).