1-oxa-4,8-diazaspiro[4.5]decane

C7H14N2O — CID 58245472

IUPAC1-oxa-4,8-diazaspiro[4.5]decane
SMILESC1CC2(CCN1)NCCO2
InChIInChI=1S/C7H14N2O/c1-3-8-4-2-7(1)9-5-6-10-7/h8-9H,1-6H2
InChIKeySOGGTLCIHHUVEW-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.31
Rot. Bonds

About 1-oxa-4,8-diazaspiro[4.5]decane

1-oxa-4,8-diazaspiro[4.5]decane (PubChem CID 58245472) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-oxa-4,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name1-oxa-4,8-diazaspiro[4.5]decane
PubChem CID58245472
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-oxa-4,8-diazaspiro[4.5]decane
SMILESC1CC2(CCN1)NCCO2
InChIInChI=1S/C7H14N2O/c1-3-8-4-2-7(1)9-5-6-10-7/h8-9H,1-6H2
InChIKeySOGGTLCIHHUVEW-UHFFFAOYSA-N
XLogP-0.31
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-oxa-4,8-diazaspiro[4.5]decane?
The IUPAC name of 1-oxa-4,8-diazaspiro[4.5]decane (CID 58245472) is 1-oxa-4,8-diazaspiro[4.5]decane.
What is the SMILES notation for 1-oxa-4,8-diazaspiro[4.5]decane?
The canonical SMILES for 1-oxa-4,8-diazaspiro[4.5]decane is C1CC2(CCN1)NCCO2.
What is the InChIKey of 1-oxa-4,8-diazaspiro[4.5]decane?
The InChIKey is SOGGTLCIHHUVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-8-4-2-7(1)9-5-6-10-7/h8-9H,1-6H2.
What are the key properties of 1-oxa-4,8-diazaspiro[4.5]decane?
1-oxa-4,8-diazaspiro[4.5]decane has a molecular weight of 142.20 g/mol, XLogP of -0.31, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-4,8-diazaspiro[4.5]decane is sourced from PubChem (CID 58245472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).