4-ethoxy-1-methylpiperidine

C8H17NO — CID 18723245

IUPAC4-ethoxy-1-methylpiperidine
SMILESCCOC1CCN(C)CC1
InChIInChI=1S/C8H17NO/c1-3-10-8-4-6-9(2)7-5-8/h8H,3-7H2,1-2H3
InChIKeyDIFHIFPYUYLFNF-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.12
Rot. Bonds2

About 4-ethoxy-1-methylpiperidine

4-ethoxy-1-methylpiperidine (PubChem CID 18723245) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-ethoxy-1-methylpiperidine.

Molecular Properties

Compound Name4-ethoxy-1-methylpiperidine
PubChem CID18723245
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-ethoxy-1-methylpiperidine
SMILESCCOC1CCN(C)CC1
InChIInChI=1S/C8H17NO/c1-3-10-8-4-6-9(2)7-5-8/h8H,3-7H2,1-2H3
InChIKeyDIFHIFPYUYLFNF-UHFFFAOYSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1-methylpiperidine?
The IUPAC name of 4-ethoxy-1-methylpiperidine (CID 18723245) is 4-ethoxy-1-methylpiperidine.
What is the SMILES notation for 4-ethoxy-1-methylpiperidine?
The canonical SMILES for 4-ethoxy-1-methylpiperidine is CCOC1CCN(C)CC1.
What is the InChIKey of 4-ethoxy-1-methylpiperidine?
The InChIKey is DIFHIFPYUYLFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-10-8-4-6-9(2)7-5-8/h8H,3-7H2,1-2H3.
What are the key properties of 4-ethoxy-1-methylpiperidine?
4-ethoxy-1-methylpiperidine has a molecular weight of 143.23 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1-methylpiperidine is sourced from PubChem (CID 18723245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).