2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane

C10H19NO — CID 166858299

IUPAC2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane
SMILESCC1COCC2(CCN(C)C2)C1
InChIInChI=1S/C10H19NO/c1-9-5-10(8-12-6-9)3-4-11(2)7-10/h9H,3-8H2,1-2H3
InChIKeyLOMJHMHVQZYCGZ-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.36
Rot. Bonds

About 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane

2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane (PubChem CID 166858299) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane
PubChem CID166858299
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane
SMILESCC1COCC2(CCN(C)C2)C1
InChIInChI=1S/C10H19NO/c1-9-5-10(8-12-6-9)3-4-11(2)7-10/h9H,3-8H2,1-2H3
InChIKeyLOMJHMHVQZYCGZ-UHFFFAOYSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane?
The IUPAC name of 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane (CID 166858299) is 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane.
What is the SMILES notation for 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane?
The canonical SMILES for 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane is CC1COCC2(CCN(C)C2)C1.
What is the InChIKey of 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane?
The InChIKey is LOMJHMHVQZYCGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9-5-10(8-12-6-9)3-4-11(2)7-10/h9H,3-8H2,1-2H3.
What are the key properties of 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane?
2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane has a molecular weight of 169.27 g/mol, XLogP of 1.36, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-dimethyl-7-oxa-2-azaspiro[4.5]decane is sourced from PubChem (CID 166858299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).