N-(fluoromethyl)piperidine-1-sulfonamide

C6H13FN2O2S — CID 174543405

IUPACN-(fluoromethyl)piperidine-1-sulfonamide
SMILESO=S(=O)(NCF)N1CCCCC1
InChIInChI=1S/C6H13FN2O2S/c7-6-8-12(10,11)9-4-2-1-3-5-9/h8H,1-6H2
InChIKeyCZXZGIVBSVCJPM-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.23
Rot. Bonds3

About N-(fluoromethyl)piperidine-1-sulfonamide

N-(fluoromethyl)piperidine-1-sulfonamide (PubChem CID 174543405) has the molecular formula C6H13FN2O2S and a molecular weight of 196.25 g/mol. Its IUPAC name is N-(fluoromethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(fluoromethyl)piperidine-1-sulfonamide
PubChem CID174543405
Molecular FormulaC6H13FN2O2S
Molecular Weight196.25 g/mol
Exact Mass196.07
IUPAC NameN-(fluoromethyl)piperidine-1-sulfonamide
SMILESO=S(=O)(NCF)N1CCCCC1
InChIInChI=1S/C6H13FN2O2S/c7-6-8-12(10,11)9-4-2-1-3-5-9/h8H,1-6H2
InChIKeyCZXZGIVBSVCJPM-UHFFFAOYSA-N
XLogP0.23
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(fluoromethyl)piperidine-1-sulfonamide?
The IUPAC name of N-(fluoromethyl)piperidine-1-sulfonamide (CID 174543405) is N-(fluoromethyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(fluoromethyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(fluoromethyl)piperidine-1-sulfonamide is O=S(=O)(NCF)N1CCCCC1.
What is the InChIKey of N-(fluoromethyl)piperidine-1-sulfonamide?
The InChIKey is CZXZGIVBSVCJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FN2O2S/c7-6-8-12(10,11)9-4-2-1-3-5-9/h8H,1-6H2.
What are the key properties of N-(fluoromethyl)piperidine-1-sulfonamide?
N-(fluoromethyl)piperidine-1-sulfonamide has a molecular weight of 196.25 g/mol, XLogP of 0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(fluoromethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 174543405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).