2-(phenylmethoxymethyl)piperidine

C13H19NO — CID 14449341

IUPAC2-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCC2CCCCN2)cc1
InChIInChI=1S/C13H19NO/c1-2-6-12(7-3-1)10-15-11-13-8-4-5-9-14-13/h1-3,6-7,13-14H,4-5,8-11H2
InChIKeyQJQFTDCEQKMEFU-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.35
Rot. Bonds4

About 2-(phenylmethoxymethyl)piperidine

2-(phenylmethoxymethyl)piperidine (PubChem CID 14449341) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(phenylmethoxymethyl)piperidine.

Molecular Properties

Compound Name2-(phenylmethoxymethyl)piperidine
PubChem CID14449341
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCC2CCCCN2)cc1
InChIInChI=1S/C13H19NO/c1-2-6-12(7-3-1)10-15-11-13-8-4-5-9-14-13/h1-3,6-7,13-14H,4-5,8-11H2
InChIKeyQJQFTDCEQKMEFU-UHFFFAOYSA-N
XLogP2.35
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(phenylmethoxymethyl)piperidine?
The IUPAC name of 2-(phenylmethoxymethyl)piperidine (CID 14449341) is 2-(phenylmethoxymethyl)piperidine.
What is the SMILES notation for 2-(phenylmethoxymethyl)piperidine?
The canonical SMILES for 2-(phenylmethoxymethyl)piperidine is c1ccc(COCC2CCCCN2)cc1.
What is the InChIKey of 2-(phenylmethoxymethyl)piperidine?
The InChIKey is QJQFTDCEQKMEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-6-12(7-3-1)10-15-11-13-8-4-5-9-14-13/h1-3,6-7,13-14H,4-5,8-11H2.
What are the key properties of 2-(phenylmethoxymethyl)piperidine?
2-(phenylmethoxymethyl)piperidine has a molecular weight of 205.30 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenylmethoxymethyl)piperidine is sourced from PubChem (CID 14449341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).