4-(2-phenoxyphenyl)piperidine

C17H19NO — CID 23113096

IUPAC4-(2-phenoxyphenyl)piperidine
SMILESc1ccc(Oc2ccccc2C2CCNCC2)cc1
InChIInChI=1S/C17H19NO/c1-2-6-15(7-3-1)19-17-9-5-4-8-16(17)14-10-12-18-13-11-14/h1-9,14,18H,10-13H2
InChIKeyYWIYMDPWBAXEKQ-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.95
Rot. Bonds3

About 4-(2-phenoxyphenyl)piperidine

4-(2-phenoxyphenyl)piperidine (PubChem CID 23113096) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-(2-phenoxyphenyl)piperidine.

Molecular Properties

Compound Name4-(2-phenoxyphenyl)piperidine
PubChem CID23113096
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name4-(2-phenoxyphenyl)piperidine
SMILESc1ccc(Oc2ccccc2C2CCNCC2)cc1
InChIInChI=1S/C17H19NO/c1-2-6-15(7-3-1)19-17-9-5-4-8-16(17)14-10-12-18-13-11-14/h1-9,14,18H,10-13H2
InChIKeyYWIYMDPWBAXEKQ-UHFFFAOYSA-N
XLogP3.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-phenoxyphenyl)piperidine?
The IUPAC name of 4-(2-phenoxyphenyl)piperidine (CID 23113096) is 4-(2-phenoxyphenyl)piperidine.
What is the SMILES notation for 4-(2-phenoxyphenyl)piperidine?
The canonical SMILES for 4-(2-phenoxyphenyl)piperidine is c1ccc(Oc2ccccc2C2CCNCC2)cc1.
What is the InChIKey of 4-(2-phenoxyphenyl)piperidine?
The InChIKey is YWIYMDPWBAXEKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-2-6-15(7-3-1)19-17-9-5-4-8-16(17)14-10-12-18-13-11-14/h1-9,14,18H,10-13H2.
What are the key properties of 4-(2-phenoxyphenyl)piperidine?
4-(2-phenoxyphenyl)piperidine has a molecular weight of 253.35 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenoxyphenyl)piperidine is sourced from PubChem (CID 23113096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).