1-methyl-4-phenylmethoxypiperidine

C13H19NO — CID 12796423

IUPAC1-methyl-4-phenylmethoxypiperidine
SMILESCN1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C13H19NO/c1-14-9-7-13(8-10-14)15-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3
InChIKeyLFFNGOXYJGVUPD-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.30
Rot. Bonds3

About 1-methyl-4-phenylmethoxypiperidine

1-methyl-4-phenylmethoxypiperidine (PubChem CID 12796423) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-methyl-4-phenylmethoxypiperidine.

Molecular Properties

Compound Name1-methyl-4-phenylmethoxypiperidine
PubChem CID12796423
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-methyl-4-phenylmethoxypiperidine
SMILESCN1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C13H19NO/c1-14-9-7-13(8-10-14)15-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3
InChIKeyLFFNGOXYJGVUPD-UHFFFAOYSA-N
XLogP2.30
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-phenylmethoxypiperidine?
The IUPAC name of 1-methyl-4-phenylmethoxypiperidine (CID 12796423) is 1-methyl-4-phenylmethoxypiperidine.
What is the SMILES notation for 1-methyl-4-phenylmethoxypiperidine?
The canonical SMILES for 1-methyl-4-phenylmethoxypiperidine is CN1CCC(OCc2ccccc2)CC1.
What is the InChIKey of 1-methyl-4-phenylmethoxypiperidine?
The InChIKey is LFFNGOXYJGVUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-9-7-13(8-10-14)15-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3.
What are the key properties of 1-methyl-4-phenylmethoxypiperidine?
1-methyl-4-phenylmethoxypiperidine has a molecular weight of 205.30 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-phenylmethoxypiperidine is sourced from PubChem (CID 12796423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).