N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide

C16H20FN3O3S — CID 128974333

IUPACN-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide
SMILESCCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C16H20FN3O3S/c1-2-20-10-13(9-18-20)16-15(7-8-23-16)19-24(21,22)11-12-5-3-4-6-14(12)17/h3-6,9-10,15-16,19H,2,7-8,11H2,1H3/t15-,16+/m0/s1
InChIKeyWFNJVPVQWWEWNR-JKSUJKDBSA-N
MW353.42 g/mol
LogP1.99
Rot. Bonds6

About N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide

N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide (PubChem CID 128974333) has the molecular formula C16H20FN3O3S and a molecular weight of 353.42 g/mol. Its IUPAC name is N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide.

Molecular Properties

Compound NameN-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide
PubChem CID128974333
Molecular FormulaC16H20FN3O3S
Molecular Weight353.42 g/mol
Exact Mass353.12
IUPAC NameN-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide
SMILESCCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C16H20FN3O3S/c1-2-20-10-13(9-18-20)16-15(7-8-23-16)19-24(21,22)11-12-5-3-4-6-14(12)17/h3-6,9-10,15-16,19H,2,7-8,11H2,1H3/t15-,16+/m0/s1
InChIKeyWFNJVPVQWWEWNR-JKSUJKDBSA-N
XLogP1.99
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)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-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide?
The IUPAC name of N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide (CID 128974333) is N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide.
What is the SMILES notation for N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide?
The canonical SMILES for N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide is CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)Cc2ccccc2F)cn1.
What is the InChIKey of N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide?
The InChIKey is WFNJVPVQWWEWNR-JKSUJKDBSA-N. The full InChI is InChI=1S/C16H20FN3O3S/c1-2-20-10-13(9-18-20)16-15(7-8-23-16)19-24(21,22)11-12-5-3-4-6-14(12)17/h3-6,9-10,15-16,19H,2,7-8,11H2,1H3/t15-,16+/m0/s1.
What are the key properties of N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide?
N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide has a molecular weight of 353.42 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3S)-2-(1-ethylpyrazol-4-yl)oxolan-3-yl]-1-(2-fluorophenyl)methanesulfonamide is sourced from PubChem (CID 128974333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).