N-(2-fluoroethyl)azetidine-1-sulfonamide

C5H11FN2O2S — CID 131224238

IUPACN-(2-fluoroethyl)azetidine-1-sulfonamide
SMILESO=S(=O)(NCCF)N1CCC1
InChIInChI=1S/C5H11FN2O2S/c6-2-3-7-11(9,10)8-4-1-5-8/h7H,1-5H2
InChIKeyDJAKLXBTCNCUDB-UHFFFAOYSA-N
MW182.22 g/mol
LogP-0.50
Rot. Bonds4

About N-(2-fluoroethyl)azetidine-1-sulfonamide

N-(2-fluoroethyl)azetidine-1-sulfonamide (PubChem CID 131224238) has the molecular formula C5H11FN2O2S and a molecular weight of 182.22 g/mol. Its IUPAC name is N-(2-fluoroethyl)azetidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)azetidine-1-sulfonamide
PubChem CID131224238
Molecular FormulaC5H11FN2O2S
Molecular Weight182.22 g/mol
Exact Mass182.05
IUPAC NameN-(2-fluoroethyl)azetidine-1-sulfonamide
SMILESO=S(=O)(NCCF)N1CCC1
InChIInChI=1S/C5H11FN2O2S/c6-2-3-7-11(9,10)8-4-1-5-8/h7H,1-5H2
InChIKeyDJAKLXBTCNCUDB-UHFFFAOYSA-N
XLogP-0.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)azetidine-1-sulfonamide?
The IUPAC name of N-(2-fluoroethyl)azetidine-1-sulfonamide (CID 131224238) is N-(2-fluoroethyl)azetidine-1-sulfonamide.
What is the SMILES notation for N-(2-fluoroethyl)azetidine-1-sulfonamide?
The canonical SMILES for N-(2-fluoroethyl)azetidine-1-sulfonamide is O=S(=O)(NCCF)N1CCC1.
What is the InChIKey of N-(2-fluoroethyl)azetidine-1-sulfonamide?
The InChIKey is DJAKLXBTCNCUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2O2S/c6-2-3-7-11(9,10)8-4-1-5-8/h7H,1-5H2.
What are the key properties of N-(2-fluoroethyl)azetidine-1-sulfonamide?
N-(2-fluoroethyl)azetidine-1-sulfonamide has a molecular weight of 182.22 g/mol, XLogP of -0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)azetidine-1-sulfonamide is sourced from PubChem (CID 131224238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).