2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole

C8H10F2N2S — CID 105456190

IUPAC2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole
SMILESFC1(F)CNCC(c2nccs2)C1
InChIInChI=1S/C8H10F2N2S/c9-8(10)3-6(4-11-5-8)7-12-1-2-13-7/h1-2,6,11H,3-5H2
InChIKeyFVOGVWPUWPGFNE-UHFFFAOYSA-N
MW204.24 g/mol
LogP1.86
Rot. Bonds1

About 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole

2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole (PubChem CID 105456190) has the molecular formula C8H10F2N2S and a molecular weight of 204.24 g/mol. Its IUPAC name is 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole
PubChem CID105456190
Molecular FormulaC8H10F2N2S
Molecular Weight204.24 g/mol
Exact Mass204.05
IUPAC Name2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole
SMILESFC1(F)CNCC(c2nccs2)C1
InChIInChI=1S/C8H10F2N2S/c9-8(10)3-6(4-11-5-8)7-12-1-2-13-7/h1-2,6,11H,3-5H2
InChIKeyFVOGVWPUWPGFNE-UHFFFAOYSA-N
XLogP1.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-(1,3-thiazol-2-yl)spiro[4.5]decane-1,4-dione
CID 150389360
2-[1-(trideuteriomethyl)piperidin-4-yl]-1,3-thiazole
CID 170533293
(2S,4S)-4-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 170164499
2-(1-methanidylpiperidin-4-yl)-1,3-thiazole;tungsten
CID 59496771
[4-(1,3-thiazol-2-yl)cyclohexyl]methanamine;hydrochloride
CID 158523431
2-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 7047975
methyl (2S,4S)-4-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylate;hydrochloride
CID 169198353
5-cyclopropyl-3,3-difluoropiperidine
CID 163580100
4,4-dimethyl-6-(1,3-thiazol-2-yl)cyclohex-2-en-1-one
CID 18320148
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]-3-(1,3-thiazol-2-yl)cyclopentan-1-amine
CID 155794236
[(3R,4S)-4-(1-methylpyrazol-4-yl)pyrrolidin-3-yl]-[4-(1,3-thiazol-2-yl)piperidin-1-yl]methanone;dihydrochloride
CID 120940784
2-(2-piperidin-4-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-7-yl)-1,3-thiazole
CID 136837431

Frequently Asked Questions

What is the IUPAC name of 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole?
The IUPAC name of 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole (CID 105456190) is 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole.
What is the SMILES notation for 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole?
The canonical SMILES for 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole is FC1(F)CNCC(c2nccs2)C1.
What is the InChIKey of 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole?
The InChIKey is FVOGVWPUWPGFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2S/c9-8(10)3-6(4-11-5-8)7-12-1-2-13-7/h1-2,6,11H,3-5H2.
What are the key properties of 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole?
2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole has a molecular weight of 204.24 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,5-difluoropiperidin-3-yl)-1,3-thiazole is sourced from PubChem (CID 105456190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).