4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine

C13H27NO — CID 137419991

IUPAC4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine
SMILESCCOC1CC(C)(C)N(CC)C(C)(C)C1
InChIInChI=1S/C13H27NO/c1-7-14-12(3,4)9-11(15-8-2)10-13(14,5)6/h11H,7-10H2,1-6H3
InChIKeyALKAUNJWGUPSFV-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.06
Rot. Bonds3

About 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine

4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine (PubChem CID 137419991) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine
PubChem CID137419991
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine
SMILESCCOC1CC(C)(C)N(CC)C(C)(C)C1
InChIInChI=1S/C13H27NO/c1-7-14-12(3,4)9-11(15-8-2)10-13(14,5)6/h11H,7-10H2,1-6H3
InChIKeyALKAUNJWGUPSFV-UHFFFAOYSA-N
XLogP3.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine (CID 137419991) is 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine is CCOC1CC(C)(C)N(CC)C(C)(C)C1.
What is the InChIKey of 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine?
The InChIKey is ALKAUNJWGUPSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-7-14-12(3,4)9-11(15-8-2)10-13(14,5)6/h11H,7-10H2,1-6H3.
What are the key properties of 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine?
4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine has a molecular weight of 213.36 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1-ethyl-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 137419991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).