4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine

C19H19F4NO — CID 11842630

IUPAC4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine
SMILESFc1ccc(C2(OCc3ccc(C(F)(F)F)cc3)CCNCC2)cc1
InChIInChI=1S/C19H19F4NO/c20-17-7-5-15(6-8-17)18(9-11-24-12-10-18)25-13-14-1-3-16(4-2-14)19(21,22)23/h1-8,24H,9-13H2
InChIKeySJGMTUMGBPCKML-UHFFFAOYSA-N
MW353.36 g/mol
LogP4.64
Rot. Bonds4

About 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine

4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine (PubChem CID 11842630) has the molecular formula C19H19F4NO and a molecular weight of 353.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine
PubChem CID11842630
Molecular FormulaC19H19F4NO
Molecular Weight353.36 g/mol
Exact Mass353.14
IUPAC Name4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine
SMILESFc1ccc(C2(OCc3ccc(C(F)(F)F)cc3)CCNCC2)cc1
InChIInChI=1S/C19H19F4NO/c20-17-7-5-15(6-8-17)18(9-11-24-12-10-18)25-13-14-1-3-16(4-2-14)19(21,22)23/h1-8,24H,9-13H2
InChIKeySJGMTUMGBPCKML-UHFFFAOYSA-N
XLogP4.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.36
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine?
The IUPAC name of 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine (CID 11842630) is 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine.
What is the SMILES notation for 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine?
The canonical SMILES for 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine is Fc1ccc(C2(OCc3ccc(C(F)(F)F)cc3)CCNCC2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine?
The InChIKey is SJGMTUMGBPCKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F4NO/c20-17-7-5-15(6-8-17)18(9-11-24-12-10-18)25-13-14-1-3-16(4-2-14)19(21,22)23/h1-8,24H,9-13H2.
What are the key properties of 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine?
4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine has a molecular weight of 353.36 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]piperidine is sourced from PubChem (CID 11842630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).