methoxymethane;1-(2-phenylethyl)piperidin-4-one

C15H23NO2 — CID 91011743

IUPACmethoxymethane;1-(2-phenylethyl)piperidin-4-one
SMILESCOC.O=C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C13H17NO.C2H6O/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12;1-3-2/h1-5H,6-11H2;1-2H3
InChIKeyZRPNEMOQMPUEQM-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.16
Rot. Bonds3

About methoxymethane;1-(2-phenylethyl)piperidin-4-one

methoxymethane;1-(2-phenylethyl)piperidin-4-one (PubChem CID 91011743) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is methoxymethane;1-(2-phenylethyl)piperidin-4-one.

Molecular Properties

Compound Namemethoxymethane;1-(2-phenylethyl)piperidin-4-one
PubChem CID91011743
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Namemethoxymethane;1-(2-phenylethyl)piperidin-4-one
SMILESCOC.O=C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C13H17NO.C2H6O/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12;1-3-2/h1-5H,6-11H2;1-2H3
InChIKeyZRPNEMOQMPUEQM-UHFFFAOYSA-N
XLogP2.16
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;1-(2-phenylethyl)piperidin-4-one?
The IUPAC name of methoxymethane;1-(2-phenylethyl)piperidin-4-one (CID 91011743) is methoxymethane;1-(2-phenylethyl)piperidin-4-one.
What is the SMILES notation for methoxymethane;1-(2-phenylethyl)piperidin-4-one?
The canonical SMILES for methoxymethane;1-(2-phenylethyl)piperidin-4-one is COC.O=C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of methoxymethane;1-(2-phenylethyl)piperidin-4-one?
The InChIKey is ZRPNEMOQMPUEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO.C2H6O/c15-13-7-10-14(11-8-13)9-6-12-4-2-1-3-5-12;1-3-2/h1-5H,6-11H2;1-2H3.
What are the key properties of methoxymethane;1-(2-phenylethyl)piperidin-4-one?
methoxymethane;1-(2-phenylethyl)piperidin-4-one has a molecular weight of 249.35 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;1-(2-phenylethyl)piperidin-4-one is sourced from PubChem (CID 91011743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).