6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine

C19H21F3N2O2 — CID 68594815

IUPAC6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine
SMILESCc1ccc(OCC2CCCNC2)c(Oc2cccc(C(F)(F)F)c2)n1
InChIInChI=1S/C19H21F3N2O2/c1-13-7-8-17(25-12-14-4-3-9-23-11-14)18(24-13)26-16-6-2-5-15(10-16)19(20,21)22/h2,5-8,10,14,23H,3-4,9,11-12H2,1H3
InChIKeySLDLFCJIMQWNSQ-UHFFFAOYSA-N
MW366.38 g/mol
LogP4.58
Rot. Bonds5

About 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine

6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine (PubChem CID 68594815) has the molecular formula C19H21F3N2O2 and a molecular weight of 366.38 g/mol. Its IUPAC name is 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine.

Molecular Properties

Compound Name6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine
PubChem CID68594815
Molecular FormulaC19H21F3N2O2
Molecular Weight366.38 g/mol
Exact Mass366.16
IUPAC Name6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine
SMILESCc1ccc(OCC2CCCNC2)c(Oc2cccc(C(F)(F)F)c2)n1
InChIInChI=1S/C19H21F3N2O2/c1-13-7-8-17(25-12-14-4-3-9-23-11-14)18(24-13)26-16-6-2-5-15(10-16)19(20,21)22/h2,5-8,10,14,23H,3-4,9,11-12H2,1H3
InChIKeySLDLFCJIMQWNSQ-UHFFFAOYSA-N
XLogP4.58
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.38
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine?
The IUPAC name of 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine (CID 68594815) is 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine.
What is the SMILES notation for 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine?
The canonical SMILES for 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine is Cc1ccc(OCC2CCCNC2)c(Oc2cccc(C(F)(F)F)c2)n1.
What is the InChIKey of 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine?
The InChIKey is SLDLFCJIMQWNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F3N2O2/c1-13-7-8-17(25-12-14-4-3-9-23-11-14)18(24-13)26-16-6-2-5-15(10-16)19(20,21)22/h2,5-8,10,14,23H,3-4,9,11-12H2,1H3.
What are the key properties of 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine?
6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine has a molecular weight of 366.38 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(piperidin-3-ylmethoxy)-2-[3-(trifluoromethyl)phenoxy]pyridine is sourced from PubChem (CID 68594815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).