5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole

C15H16F3N3O2 — CID 118862367

IUPAC5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole
SMILESCOC1CCN(c2cc(C(F)(F)F)cc(-c3cnco3)n2)CC1
InChIInChI=1S/C15H16F3N3O2/c1-22-11-2-4-21(5-3-11)14-7-10(15(16,17)18)6-12(20-14)13-8-19-9-23-13/h6-9,11H,2-5H2,1H3
InChIKeyGCAOWJOGTLZXTM-UHFFFAOYSA-N
MW327.31 g/mol
LogP3.37
Rot. Bonds3

About 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole

5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole (PubChem CID 118862367) has the molecular formula C15H16F3N3O2 and a molecular weight of 327.31 g/mol. Its IUPAC name is 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole.

Molecular Properties

Compound Name5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole
PubChem CID118862367
Molecular FormulaC15H16F3N3O2
Molecular Weight327.31 g/mol
Exact Mass327.12
IUPAC Name5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole
SMILESCOC1CCN(c2cc(C(F)(F)F)cc(-c3cnco3)n2)CC1
InChIInChI=1S/C15H16F3N3O2/c1-22-11-2-4-21(5-3-11)14-7-10(15(16,17)18)6-12(20-14)13-8-19-9-23-13/h6-9,11H,2-5H2,1H3
InChIKeyGCAOWJOGTLZXTM-UHFFFAOYSA-N
XLogP3.37
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.31
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102720443
6-(3-methoxypyrrolidin-1-yl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 103541738
N-[6-(1,3-oxazol-5-yl)-4-(trifluoromethyl)-2-pyridinyl]acetamide
CID 118862336
2-ethenyl-6-(4-methoxypiperidin-1-yl)-4-methylpyridine
CID 171542301
1-[6-amino-4-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol
CID 102717208
2,5-dichloro-6-(4-methoxypiperidin-1-yl)-3-(trifluoromethyl)pyridine
CID 122142004
4-fluoro-6-(4-methoxypiperidin-1-yl)pyrimidine
CID 115416496
[6-(4-methoxypiperidin-1-yl)pyrazin-2-yl]hydrazine
CID 80895399
1-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]-4-propan-2-ylazepane
CID 102715943
[6-(4-propan-2-ylpiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 103504770
(3R)-1-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-amine
CID 68804646
4-fluoro-2-(4-methoxypiperidin-1-yl)pyridine
CID 70661184

Frequently Asked Questions

What is the IUPAC name of 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole?
The IUPAC name of 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole (CID 118862367) is 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole.
What is the SMILES notation for 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole?
The canonical SMILES for 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole is COC1CCN(c2cc(C(F)(F)F)cc(-c3cnco3)n2)CC1.
What is the InChIKey of 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole?
The InChIKey is GCAOWJOGTLZXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N3O2/c1-22-11-2-4-21(5-3-11)14-7-10(15(16,17)18)6-12(20-14)13-8-19-9-23-13/h6-9,11H,2-5H2,1H3.
What are the key properties of 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole?
5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole has a molecular weight of 327.31 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(4-methoxypiperidin-1-yl)-4-(trifluoromethyl)-2-pyridinyl]-1,3-oxazole is sourced from PubChem (CID 118862367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).