[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol

C9H13FN2OS — CID 175265109

IUPAC[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(C2(F)CCNCC2)s1
InChIInChI=1S/C9H13FN2OS/c10-9(1-3-11-4-2-9)8-12-5-7(6-13)14-8/h5,11,13H,1-4,6H2
InChIKeyIGFVYAYTRLLZMT-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.18
Rot. Bonds2

About [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol

[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 175265109) has the molecular formula C9H13FN2OS and a molecular weight of 216.28 g/mol. Its IUPAC name is [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol
PubChem CID175265109
Molecular FormulaC9H13FN2OS
Molecular Weight216.28 g/mol
Exact Mass216.07
IUPAC Name[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(C2(F)CCNCC2)s1
InChIInChI=1S/C9H13FN2OS/c10-9(1-3-11-4-2-9)8-12-5-7(6-13)14-8/h5,11,13H,1-4,6H2
InChIKeyIGFVYAYTRLLZMT-UHFFFAOYSA-N
XLogP1.18
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-Fluoro-4-[5-(hydroxymethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylic acid
CID 154126466
[2-[[(3S)-1-(3-fluoropropyl)pyrrolidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol
CID 170950909
[2-[[(3R)-1-(3-fluoropropyl)pyrrolidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol
CID 170950945
5-(Fluoromethyl)-2-piperidin-4-yl-1,3-thiazole
CID 84775889
5-(Fluoromethyl)-2-(piperidin-4-ylmethyl)-1,3-thiazole
CID 84783507
4-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]piperidin-4-ol
CID 106781996
Piperidin-4-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106782198
5-(Methoxymethyl)-2-piperidin-4-yl-1,3-thiazole
CID 58746977
(2-Cyclohexylthiazol-5-yl)methanol
CID 64981659
4-(5-Methyl-1,3-thiazol-2-yl)piperidin-4-ol
CID 69450404
[2-(Cyclopropylmethyl)-1,3-thiazol-5-yl]methanol
CID 80485890
[2-(3-Methylpentan-3-yl)-1,3-thiazol-5-yl]methanol
CID 138574729

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol (CID 175265109) is [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol is OCc1cnc(C2(F)CCNCC2)s1.
What is the InChIKey of [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is IGFVYAYTRLLZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2OS/c10-9(1-3-11-4-2-9)8-12-5-7(6-13)14-8/h5,11,13H,1-4,6H2.
What are the key properties of [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol?
[2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 216.28 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 175265109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).