4-(ethoxymethyl)-3-methoxypiperidine

C9H19NO2 — CID 20696752

IUPAC4-(ethoxymethyl)-3-methoxypiperidine
SMILESCCOCC1CCNCC1OC
InChIInChI=1S/C9H19NO2/c1-3-12-7-8-4-5-10-6-9(8)11-2/h8-10H,3-7H2,1-2H3
InChIKeyNHQTXHVFUOSEJB-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.65
Rot. Bonds4

About 4-(ethoxymethyl)-3-methoxypiperidine

4-(ethoxymethyl)-3-methoxypiperidine (PubChem CID 20696752) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-(ethoxymethyl)-3-methoxypiperidine.

Molecular Properties

Compound Name4-(ethoxymethyl)-3-methoxypiperidine
PubChem CID20696752
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name4-(ethoxymethyl)-3-methoxypiperidine
SMILESCCOCC1CCNCC1OC
InChIInChI=1S/C9H19NO2/c1-3-12-7-8-4-5-10-6-9(8)11-2/h8-10H,3-7H2,1-2H3
InChIKeyNHQTXHVFUOSEJB-UHFFFAOYSA-N
XLogP0.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(ethoxymethyl)-3-methoxypiperidine?
The IUPAC name of 4-(ethoxymethyl)-3-methoxypiperidine (CID 20696752) is 4-(ethoxymethyl)-3-methoxypiperidine.
What is the SMILES notation for 4-(ethoxymethyl)-3-methoxypiperidine?
The canonical SMILES for 4-(ethoxymethyl)-3-methoxypiperidine is CCOCC1CCNCC1OC.
What is the InChIKey of 4-(ethoxymethyl)-3-methoxypiperidine?
The InChIKey is NHQTXHVFUOSEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-12-7-8-4-5-10-6-9(8)11-2/h8-10H,3-7H2,1-2H3.
What are the key properties of 4-(ethoxymethyl)-3-methoxypiperidine?
4-(ethoxymethyl)-3-methoxypiperidine has a molecular weight of 173.26 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethoxymethyl)-3-methoxypiperidine is sourced from PubChem (CID 20696752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).