2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine

C19H25F3N2O — CID 178135409

IUPAC2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine
SMILESFC(F)(F)C12CCC(COc3cccc(C4CCNCC4)n3)(CC1)C2
InChIInChI=1S/C19H25F3N2O/c20-19(21,22)18-8-6-17(12-18,7-9-18)13-25-16-3-1-2-15(24-16)14-4-10-23-11-5-14/h1-3,14,23H,4-13H2
InChIKeyAGVUKUORHZQAQP-UHFFFAOYSA-N
MW354.42 g/mol
LogP4.44
Rot. Bonds4

About 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine

2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine (PubChem CID 178135409) has the molecular formula C19H25F3N2O and a molecular weight of 354.42 g/mol. Its IUPAC name is 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine.

Molecular Properties

Compound Name2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine
PubChem CID178135409
Molecular FormulaC19H25F3N2O
Molecular Weight354.42 g/mol
Exact Mass354.19
IUPAC Name2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine
SMILESFC(F)(F)C12CCC(COc3cccc(C4CCNCC4)n3)(CC1)C2
InChIInChI=1S/C19H25F3N2O/c20-19(21,22)18-8-6-17(12-18,7-9-18)13-25-16-3-1-2-15(24-16)14-4-10-23-11-5-14/h1-3,14,23H,4-13H2
InChIKeyAGVUKUORHZQAQP-UHFFFAOYSA-N
XLogP4.44
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]-1,3-benzothiazole
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2-(1-benzofuran-3-ylmethoxy)-6-piperidin-4-ylpyridine
CID 163230836
6-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]quinoline
CID 175576427
2-piperidin-4-yl-6-(1H-pyrazol-5-yl)pyridine
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2-[[2-methyl-4-(trifluoromethyl)-1-benzofuran-7-yl]methoxy]-6-piperidin-4-ylpyridine;hydrochloride
CID 162352228
2-piperidin-4-yl-6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
CID 53250882
N,N-dimethyl-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]benzamide
CID 175451125
7-chloro-4-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]quinoline
CID 167020774
1-methyl-6-[(6-piperidin-4-yl-2-pyridinyl)oxymethyl]indazole
CID 163230731
2-[(2,4-dichloro-1-benzofuran-7-yl)methoxy]-6-piperidin-4-ylpyridine
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2-piperidin-4-yl-8-(trifluoromethyl)quinoline
CID 70241298

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine?
The IUPAC name of 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine (CID 178135409) is 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine.
What is the SMILES notation for 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine?
The canonical SMILES for 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine is FC(F)(F)C12CCC(COc3cccc(C4CCNCC4)n3)(CC1)C2.
What is the InChIKey of 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine?
The InChIKey is AGVUKUORHZQAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25F3N2O/c20-19(21,22)18-8-6-17(12-18,7-9-18)13-25-16-3-1-2-15(24-16)14-4-10-23-11-5-14/h1-3,14,23H,4-13H2.
What are the key properties of 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine?
2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine has a molecular weight of 354.42 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-6-[[4-(trifluoromethyl)-1-bicyclo[2.2.1]heptanyl]methoxy]pyridine is sourced from PubChem (CID 178135409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).