4-(phenylmethoxymethyl)piperidine

C13H19NO — CID 6484121

IUPAC4-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCC2CCNCC2)cc1
InChIInChI=1S/C13H19NO/c1-2-4-12(5-3-1)10-15-11-13-6-8-14-9-7-13/h1-5,13-14H,6-11H2
InChIKeySOELBQXHXWNGLK-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.20
Rot. Bonds4

About 4-(phenylmethoxymethyl)piperidine

4-(phenylmethoxymethyl)piperidine (PubChem CID 6484121) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(phenylmethoxymethyl)piperidine.

Molecular Properties

Compound Name4-(phenylmethoxymethyl)piperidine
PubChem CID6484121
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCC2CCNCC2)cc1
InChIInChI=1S/C13H19NO/c1-2-4-12(5-3-1)10-15-11-13-6-8-14-9-7-13/h1-5,13-14H,6-11H2
InChIKeySOELBQXHXWNGLK-UHFFFAOYSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(phenylmethoxymethyl)piperidine?
The IUPAC name of 4-(phenylmethoxymethyl)piperidine (CID 6484121) is 4-(phenylmethoxymethyl)piperidine.
What is the SMILES notation for 4-(phenylmethoxymethyl)piperidine?
The canonical SMILES for 4-(phenylmethoxymethyl)piperidine is c1ccc(COCC2CCNCC2)cc1.
What is the InChIKey of 4-(phenylmethoxymethyl)piperidine?
The InChIKey is SOELBQXHXWNGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-4-12(5-3-1)10-15-11-13-6-8-14-9-7-13/h1-5,13-14H,6-11H2.
What are the key properties of 4-(phenylmethoxymethyl)piperidine?
4-(phenylmethoxymethyl)piperidine has a molecular weight of 205.30 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(phenylmethoxymethyl)piperidine is sourced from PubChem (CID 6484121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).