6-ethyl-2-oxa-7-azaspiro[3.5]nonane

C9H17NO — CID 146204485

IUPAC6-ethyl-2-oxa-7-azaspiro[3.5]nonane
SMILESCCC1CC2(CCN1)COC2
InChIInChI=1S/C9H17NO/c1-2-8-5-9(3-4-10-8)6-11-7-9/h8,10H,2-7H2,1H3
InChIKeyMDOMFQFQXMFWKM-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds1

About 6-ethyl-2-oxa-7-azaspiro[3.5]nonane

6-ethyl-2-oxa-7-azaspiro[3.5]nonane (PubChem CID 146204485) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 6-ethyl-2-oxa-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name6-ethyl-2-oxa-7-azaspiro[3.5]nonane
PubChem CID146204485
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name6-ethyl-2-oxa-7-azaspiro[3.5]nonane
SMILESCCC1CC2(CCN1)COC2
InChIInChI=1S/C9H17NO/c1-2-8-5-9(3-4-10-8)6-11-7-9/h8,10H,2-7H2,1H3
InChIKeyMDOMFQFQXMFWKM-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-oxa-7-azaspiro[3.5]nonane?
The IUPAC name of 6-ethyl-2-oxa-7-azaspiro[3.5]nonane (CID 146204485) is 6-ethyl-2-oxa-7-azaspiro[3.5]nonane.
What is the SMILES notation for 6-ethyl-2-oxa-7-azaspiro[3.5]nonane?
The canonical SMILES for 6-ethyl-2-oxa-7-azaspiro[3.5]nonane is CCC1CC2(CCN1)COC2.
What is the InChIKey of 6-ethyl-2-oxa-7-azaspiro[3.5]nonane?
The InChIKey is MDOMFQFQXMFWKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-8-5-9(3-4-10-8)6-11-7-9/h8,10H,2-7H2,1H3.
What are the key properties of 6-ethyl-2-oxa-7-azaspiro[3.5]nonane?
6-ethyl-2-oxa-7-azaspiro[3.5]nonane has a molecular weight of 155.24 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-oxa-7-azaspiro[3.5]nonane is sourced from PubChem (CID 146204485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).