4-(dimethylamino)piperidine-1-sulfonyl fluoride

C7H15FN2O2S — CID 135564446

IUPAC4-(dimethylamino)piperidine-1-sulfonyl fluoride
SMILESCN(C)C1CCN(S(=O)(=O)F)CC1
InChIInChI=1S/C7H15FN2O2S/c1-9(2)7-3-5-10(6-4-7)13(8,11)12/h7H,3-6H2,1-2H3
InChIKeyWMYUBJPHOVSLHX-UHFFFAOYSA-N
MW210.27 g/mol
LogP0.23
Rot. Bonds2

About 4-(dimethylamino)piperidine-1-sulfonyl fluoride

4-(dimethylamino)piperidine-1-sulfonyl fluoride (PubChem CID 135564446) has the molecular formula C7H15FN2O2S and a molecular weight of 210.27 g/mol. Its IUPAC name is 4-(dimethylamino)piperidine-1-sulfonyl fluoride.

Molecular Properties

Compound Name4-(dimethylamino)piperidine-1-sulfonyl fluoride
PubChem CID135564446
Molecular FormulaC7H15FN2O2S
Molecular Weight210.27 g/mol
Exact Mass210.08
IUPAC Name4-(dimethylamino)piperidine-1-sulfonyl fluoride
SMILESCN(C)C1CCN(S(=O)(=O)F)CC1
InChIInChI=1S/C7H15FN2O2S/c1-9(2)7-3-5-10(6-4-7)13(8,11)12/h7H,3-6H2,1-2H3
InChIKeyWMYUBJPHOVSLHX-UHFFFAOYSA-N
XLogP0.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(dimethylamino)piperidine-1-sulfonyl fluoride 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-(dimethylamino)piperidine-1-sulfonyl fluoride?
The IUPAC name of 4-(dimethylamino)piperidine-1-sulfonyl fluoride (CID 135564446) is 4-(dimethylamino)piperidine-1-sulfonyl fluoride.
What is the SMILES notation for 4-(dimethylamino)piperidine-1-sulfonyl fluoride?
The canonical SMILES for 4-(dimethylamino)piperidine-1-sulfonyl fluoride is CN(C)C1CCN(S(=O)(=O)F)CC1.
What is the InChIKey of 4-(dimethylamino)piperidine-1-sulfonyl fluoride?
The InChIKey is WMYUBJPHOVSLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2O2S/c1-9(2)7-3-5-10(6-4-7)13(8,11)12/h7H,3-6H2,1-2H3.
What are the key properties of 4-(dimethylamino)piperidine-1-sulfonyl fluoride?
4-(dimethylamino)piperidine-1-sulfonyl fluoride has a molecular weight of 210.27 g/mol, XLogP of 0.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)piperidine-1-sulfonyl fluoride is sourced from PubChem (CID 135564446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).