4-methoxy-4-(methoxymethyl)-1-methylpiperidine

C9H19NO2 — CID 90227657

IUPAC4-methoxy-4-(methoxymethyl)-1-methylpiperidine
SMILESCOCC1(OC)CCN(C)CC1
InChIInChI=1S/C9H19NO2/c1-10-6-4-9(12-3,5-7-10)8-11-2/h4-8H2,1-3H3
InChIKeyZZOWSCJOHMSPFD-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.74
Rot. Bonds3

About 4-methoxy-4-(methoxymethyl)-1-methylpiperidine

4-methoxy-4-(methoxymethyl)-1-methylpiperidine (PubChem CID 90227657) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-methoxy-4-(methoxymethyl)-1-methylpiperidine.

Molecular Properties

Compound Name4-methoxy-4-(methoxymethyl)-1-methylpiperidine
PubChem CID90227657
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name4-methoxy-4-(methoxymethyl)-1-methylpiperidine
SMILESCOCC1(OC)CCN(C)CC1
InChIInChI=1S/C9H19NO2/c1-10-6-4-9(12-3,5-7-10)8-11-2/h4-8H2,1-3H3
InChIKeyZZOWSCJOHMSPFD-UHFFFAOYSA-N
XLogP0.74
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-(methoxymethyl)-1-methylpiperidine?
The IUPAC name of 4-methoxy-4-(methoxymethyl)-1-methylpiperidine (CID 90227657) is 4-methoxy-4-(methoxymethyl)-1-methylpiperidine.
What is the SMILES notation for 4-methoxy-4-(methoxymethyl)-1-methylpiperidine?
The canonical SMILES for 4-methoxy-4-(methoxymethyl)-1-methylpiperidine is COCC1(OC)CCN(C)CC1.
What is the InChIKey of 4-methoxy-4-(methoxymethyl)-1-methylpiperidine?
The InChIKey is ZZOWSCJOHMSPFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-10-6-4-9(12-3,5-7-10)8-11-2/h4-8H2,1-3H3.
What are the key properties of 4-methoxy-4-(methoxymethyl)-1-methylpiperidine?
4-methoxy-4-(methoxymethyl)-1-methylpiperidine has a molecular weight of 173.26 g/mol, XLogP of 0.74, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-(methoxymethyl)-1-methylpiperidine is sourced from PubChem (CID 90227657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).