3-ethyl-4-(methoxymethyl)-4-methylpiperidine

C10H21NO — CID 79309607

IUPAC3-ethyl-4-(methoxymethyl)-4-methylpiperidine
SMILESCCC1CNCCC1(C)COC
InChIInChI=1S/C10H21NO/c1-4-9-7-11-6-5-10(9,2)8-12-3/h9,11H,4-8H2,1-3H3
InChIKeyZHCPADULIDTPDY-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.66
Rot. Bonds3

About 3-ethyl-4-(methoxymethyl)-4-methylpiperidine

3-ethyl-4-(methoxymethyl)-4-methylpiperidine (PubChem CID 79309607) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3-ethyl-4-(methoxymethyl)-4-methylpiperidine.

Molecular Properties

Compound Name3-ethyl-4-(methoxymethyl)-4-methylpiperidine
PubChem CID79309607
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3-ethyl-4-(methoxymethyl)-4-methylpiperidine
SMILESCCC1CNCCC1(C)COC
InChIInChI=1S/C10H21NO/c1-4-9-7-11-6-5-10(9,2)8-12-3/h9,11H,4-8H2,1-3H3
InChIKeyZHCPADULIDTPDY-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(methoxymethyl)-4-methylpiperidine?
The IUPAC name of 3-ethyl-4-(methoxymethyl)-4-methylpiperidine (CID 79309607) is 3-ethyl-4-(methoxymethyl)-4-methylpiperidine.
What is the SMILES notation for 3-ethyl-4-(methoxymethyl)-4-methylpiperidine?
The canonical SMILES for 3-ethyl-4-(methoxymethyl)-4-methylpiperidine is CCC1CNCCC1(C)COC.
What is the InChIKey of 3-ethyl-4-(methoxymethyl)-4-methylpiperidine?
The InChIKey is ZHCPADULIDTPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-9-7-11-6-5-10(9,2)8-12-3/h9,11H,4-8H2,1-3H3.
What are the key properties of 3-ethyl-4-(methoxymethyl)-4-methylpiperidine?
3-ethyl-4-(methoxymethyl)-4-methylpiperidine has a molecular weight of 171.28 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(methoxymethyl)-4-methylpiperidine is sourced from PubChem (CID 79309607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).