Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane

C₁₂H₂₆N₂O — CID 155741469

About Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane

Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane (PubChem CID 155741469) has the molecular formula C₁₂H₂₆N₂O and a molecular weight of 214.35 g/mol. Its IUPAC name is ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane.

Molecular Properties

• Compound Name: Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane
• PubChem CID: 155741469
• Molecular Formula: C₁₂H₂₆N₂O
• Molecular Weight: 214.35 g/mol
• Exact Mass: 214.20
• IUPAC Name: ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane
• SMILES: CC.CCN1CC2(CNCC(C)(C)O2)C1
• InChI: InChI=1S/C10H20N2O.C2H6/c1-4-12-7-10(8-12)6-11-5-9(2,3)13-10;1-2/h11H,4-8H2,1-3H3;1-2H3
• InChIKey: XSWAPQRIHMXPEP-UHFFFAOYSA-N
• XLogP: 1.49
• TPSA: 24.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	214.35
LogP ≤ 5	1.49
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?

The IUPAC name of Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane (CID 155741469) is ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane.

What is the SMILES notation for Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?

The canonical SMILES for Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane is CC.CCN1CC2(CNCC(C)(C)O2)C1.

What is the InChIKey of Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?

The InChIKey is XSWAPQRIHMXPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O.C2H6/c1-4-12-7-10(8-12)6-11-5-9(2,3)13-10;1-2/h11H,4-8H2,1-3H3;1-2H3.

What are the key properties of Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane?

Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane has a molecular weight of 214.35 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Ethane;2-ethyl-6,6-dimethyl-5-oxa-2,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 155741469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155741469 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.