4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine

C22H22FNO — CID 22126353

IUPAC4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine
SMILESFc1ccc(C2CCNCC2OCc2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H22FNO/c23-20-9-7-18(8-10-20)21-11-12-24-14-22(21)25-15-16-5-6-17-3-1-2-4-19(17)13-16/h1-10,13,21-22,24H,11-12,14-15H2
InChIKeySIHGDNHQNYVKTH-UHFFFAOYSA-N
MW335.42 g/mol
LogP4.64
Rot. Bonds4

About 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine

4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine (PubChem CID 22126353) has the molecular formula C22H22FNO and a molecular weight of 335.42 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine
PubChem CID22126353
Molecular FormulaC22H22FNO
Molecular Weight335.42 g/mol
Exact Mass335.17
IUPAC Name4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine
SMILESFc1ccc(C2CCNCC2OCc2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H22FNO/c23-20-9-7-18(8-10-20)21-11-12-24-14-22(21)25-15-16-5-6-17-3-1-2-4-19(17)13-16/h1-10,13,21-22,24H,11-12,14-15H2
InChIKeySIHGDNHQNYVKTH-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 ≤ 500335.42
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)-3-(naphthalen-2-ylmethoxy)piperidine?
The IUPAC name of 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine (CID 22126353) is 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine.
What is the SMILES notation for 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine?
The canonical SMILES for 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine is Fc1ccc(C2CCNCC2OCc2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine?
The InChIKey is SIHGDNHQNYVKTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FNO/c23-20-9-7-18(8-10-20)21-11-12-24-14-22(21)25-15-16-5-6-17-3-1-2-4-19(17)13-16/h1-10,13,21-22,24H,11-12,14-15H2.
What are the key properties of 4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine?
4-(4-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine has a molecular weight of 335.42 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)-3-(naphthalen-2-ylmethoxy)piperidine is sourced from PubChem (CID 22126353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).