4-aminopiperidine-1-sulfonyl fluoride;hydrochloride

C5H12ClFN2O2S — CID 135564451

IUPAC4-aminopiperidine-1-sulfonyl fluoride;hydrochloride
SMILESCl.NC1CCN(S(=O)(=O)F)CC1
InChIInChI=1S/C5H11FN2O2S.ClH/c6-11(9,10)8-3-1-5(7)2-4-8;/h5H,1-4,7H2;1H
InChIKeyASEWKTIAWVZEEV-UHFFFAOYSA-N
MW218.68 g/mol
LogP0.05
Rot. Bonds1

About 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride

4-aminopiperidine-1-sulfonyl fluoride;hydrochloride (PubChem CID 135564451) has the molecular formula C5H12ClFN2O2S and a molecular weight of 218.68 g/mol. Its IUPAC name is 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride.

Molecular Properties

Compound Name4-aminopiperidine-1-sulfonyl fluoride;hydrochloride
PubChem CID135564451
Molecular FormulaC5H12ClFN2O2S
Molecular Weight218.68 g/mol
Exact Mass218.03
IUPAC Name4-aminopiperidine-1-sulfonyl fluoride;hydrochloride
SMILESCl.NC1CCN(S(=O)(=O)F)CC1
InChIInChI=1S/C5H11FN2O2S.ClH/c6-11(9,10)8-3-1-5(7)2-4-8;/h5H,1-4,7H2;1H
InChIKeyASEWKTIAWVZEEV-UHFFFAOYSA-N
XLogP0.05
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.68
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride 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 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride?
The IUPAC name of 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride (CID 135564451) is 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride.
What is the SMILES notation for 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride?
The canonical SMILES for 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride is Cl.NC1CCN(S(=O)(=O)F)CC1.
What is the InChIKey of 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride?
The InChIKey is ASEWKTIAWVZEEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2O2S.ClH/c6-11(9,10)8-3-1-5(7)2-4-8;/h5H,1-4,7H2;1H.
What are the key properties of 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride?
4-aminopiperidine-1-sulfonyl fluoride;hydrochloride has a molecular weight of 218.68 g/mol, XLogP of 0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopiperidine-1-sulfonyl fluoride;hydrochloride is sourced from PubChem (CID 135564451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).