1-(phenylmethoxymethyl)piperidine

C13H19NO — CID 13202369

IUPAC1-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCN2CCCCC2)cc1
InChIInChI=1S/C13H19NO/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-12H2
InChIKeyFXXKSWOIMQOWHF-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.65
Rot. Bonds4

About 1-(phenylmethoxymethyl)piperidine

1-(phenylmethoxymethyl)piperidine (PubChem CID 13202369) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(phenylmethoxymethyl)piperidine.

Molecular Properties

Compound Name1-(phenylmethoxymethyl)piperidine
PubChem CID13202369
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(phenylmethoxymethyl)piperidine
SMILESc1ccc(COCN2CCCCC2)cc1
InChIInChI=1S/C13H19NO/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-12H2
InChIKeyFXXKSWOIMQOWHF-UHFFFAOYSA-N
XLogP2.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(phenylmethoxymethyl)piperidine?
The IUPAC name of 1-(phenylmethoxymethyl)piperidine (CID 13202369) is 1-(phenylmethoxymethyl)piperidine.
What is the SMILES notation for 1-(phenylmethoxymethyl)piperidine?
The canonical SMILES for 1-(phenylmethoxymethyl)piperidine is c1ccc(COCN2CCCCC2)cc1.
What is the InChIKey of 1-(phenylmethoxymethyl)piperidine?
The InChIKey is FXXKSWOIMQOWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3-4,7-8H,2,5-6,9-12H2.
What are the key properties of 1-(phenylmethoxymethyl)piperidine?
1-(phenylmethoxymethyl)piperidine has a molecular weight of 205.30 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(phenylmethoxymethyl)piperidine is sourced from PubChem (CID 13202369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).