4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine

C24H20F6N2O2 — CID 11634401

IUPAC4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine
SMILESFC(F)(F)Oc1ccc(-c2cc(N3CCCCC3)cc(-c3ccc(OC(F)(F)F)cc3)n2)cc1
InChIInChI=1S/C24H20F6N2O2/c25-23(26,27)33-19-8-4-16(5-9-19)21-14-18(32-12-2-1-3-13-32)15-22(31-21)17-6-10-20(11-7-17)34-24(28,29)30/h4-11,14-15H,1-3,12-13H2
InChIKeyULRVUDBZMPBSBX-UHFFFAOYSA-N
MW482.42 g/mol
LogP7.20
Rot. Bonds5

About 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine

4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine (PubChem CID 11634401) has the molecular formula C24H20F6N2O2 and a molecular weight of 482.42 g/mol. Its IUPAC name is 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine.

Molecular Properties

Compound Name4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine
PubChem CID11634401
Molecular FormulaC24H20F6N2O2
Molecular Weight482.42 g/mol
Exact Mass482.14
IUPAC Name4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine
SMILESFC(F)(F)Oc1ccc(-c2cc(N3CCCCC3)cc(-c3ccc(OC(F)(F)F)cc3)n2)cc1
InChIInChI=1S/C24H20F6N2O2/c25-23(26,27)33-19-8-4-16(5-9-19)21-14-18(32-12-2-1-3-13-32)15-22(31-21)17-6-10-20(11-7-17)34-24(28,29)30/h4-11,14-15H,1-3,12-13H2
InChIKeyULRVUDBZMPBSBX-UHFFFAOYSA-N
XLogP7.20
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.42
LogP ≤ 57.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-bis[4-(trifluoromethoxy)phenyl]-4-(trifluoromethyl)pyridine
CID 134618302
1-[3-chloro-5-(trifluoromethoxy)phenyl]piperidine
CID 175748238
2-piperidin-1-yl-5-[4-(trifluoromethoxy)phenyl]pyrimidine
CID 3537747
4-deuterio-1-[4-(trifluoromethoxy)phenyl]piperidine
CID 175691853
(S)-(4-pyrrolidin-1-ylphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171252024
1-[5-(trifluoromethoxy)-2-pyridinyl]azepane
CID 133487864
1-[4-[2-[4-(trifluoromethoxy)phenyl]-4-pyridinyl]piperazin-1-yl]ethanone
CID 139573877
4-pyrrolidin-1-yl-3-[4-(trifluoromethoxy)phenyl]aniline
CID 58008274
1-[6-phenyl-2-[4-(trifluoromethoxy)phenyl]pyrimidin-4-yl]piperidin-4-ol
CID 11553437
4-iodo-2-[4-(trifluoromethoxy)phenyl]-6-(trifluoromethyl)pyridine
CID 118799175
methyl 2,6-bis[4-(trifluoromethoxy)phenyl]pyridine-4-carboxylate
CID 134634051
1-[4-(trifluoromethoxy)phenoxy]piperidine
CID 56985535

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine?
The IUPAC name of 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine (CID 11634401) is 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine.
What is the SMILES notation for 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine?
The canonical SMILES for 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine is FC(F)(F)Oc1ccc(-c2cc(N3CCCCC3)cc(-c3ccc(OC(F)(F)F)cc3)n2)cc1.
What is the InChIKey of 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine?
The InChIKey is ULRVUDBZMPBSBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F6N2O2/c25-23(26,27)33-19-8-4-16(5-9-19)21-14-18(32-12-2-1-3-13-32)15-22(31-21)17-6-10-20(11-7-17)34-24(28,29)30/h4-11,14-15H,1-3,12-13H2.
What are the key properties of 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine?
4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine has a molecular weight of 482.42 g/mol, XLogP of 7.20, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-2,6-bis[4-(trifluoromethoxy)phenyl]pyridine is sourced from PubChem (CID 11634401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).