N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide

C6H11F5N2OS — CID 557732

IUPACN-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide
SMILESO=C(NS(F)(F)(F)(F)F)N1CCCCC1
InChIInChI=1S/C6H11F5N2OS/c7-15(8,9,10,11)12-6(14)13-4-2-1-3-5-13/h1-5H2,(H,12,14)
InChIKeyFZTMXSRMEAAWEN-UHFFFAOYSA-N
MW254.22 g/mol
LogP3.40
Rot. Bonds1

About N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide

N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide (PubChem CID 557732) has the molecular formula C6H11F5N2OS and a molecular weight of 254.22 g/mol. Its IUPAC name is N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide
PubChem CID557732
Molecular FormulaC6H11F5N2OS
Molecular Weight254.22 g/mol
Exact Mass254.05
IUPAC NameN-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide
SMILESO=C(NS(F)(F)(F)(F)F)N1CCCCC1
InChIInChI=1S/C6H11F5N2OS/c7-15(8,9,10,11)12-6(14)13-4-2-1-3-5-13/h1-5H2,(H,12,14)
InChIKeyFZTMXSRMEAAWEN-UHFFFAOYSA-N
XLogP3.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.22
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Piperidinecarboxamide
CID 72887
3,3-Difluoropiperidine-1-carboxamide
CID 89026210
4,4-Difluoropiperidine-1-carboxamide
CID 116991121
2-Fluoropiperidine-1-carboxamide
CID 129279968
4,4-difluoro-N-sulfanylpiperidine-1-carboxamide
CID 132023192
3-Fluoropiperidine-1-carboxamide
CID 145756972
4-Fluoropiperidine-1-carboxamide
CID 154487767
Azane;piperidine-1-carboxamide
CID 23297547
N-sulfanylpiperidine-1-carboxamide
CID 57160802
1-(Sulfinatocarbamoyl)piperidine
CID 91802715
Piperidine-1-carbonylazanium tetrafluoroborate
CID 136416702
2-Deuteriopiperidine-1-carboxamide
CID 168863775

Frequently Asked Questions

What is the IUPAC name of N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide?
The IUPAC name of N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide (CID 557732) is N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide?
The canonical SMILES for N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide is O=C(NS(F)(F)(F)(F)F)N1CCCCC1.
What is the InChIKey of N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide?
The InChIKey is FZTMXSRMEAAWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F5N2OS/c7-15(8,9,10,11)12-6(14)13-4-2-1-3-5-13/h1-5H2,(H,12,14).
What are the key properties of N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide?
N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide has a molecular weight of 254.22 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pentafluoro-lambda6-sulfanyl)piperidine-1-carboxamide is sourced from PubChem (CID 557732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).