9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane

C11H20N2O — CID 66661077

IUPAC9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESC1COC2(CCN(C3CC3)CC2)CN1
InChIInChI=1S/C11H20N2O/c1-2-10(1)13-6-3-11(4-7-13)9-12-5-8-14-11/h10,12H,1-9H2
InChIKeyAOWQMVJAPPPIOJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.60
Rot. Bonds1

About 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane

9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane (PubChem CID 66661077) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane
PubChem CID66661077
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESC1COC2(CCN(C3CC3)CC2)CN1
InChIInChI=1S/C11H20N2O/c1-2-10(1)13-6-3-11(4-7-13)9-12-5-8-14-11/h10,12H,1-9H2
InChIKeyAOWQMVJAPPPIOJ-UHFFFAOYSA-N
XLogP0.60
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The IUPAC name of 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane (CID 66661077) is 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The canonical SMILES for 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane is C1COC2(CCN(C3CC3)CC2)CN1.
What is the InChIKey of 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The InChIKey is AOWQMVJAPPPIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-2-10(1)13-6-3-11(4-7-13)9-12-5-8-14-11/h10,12H,1-9H2.
What are the key properties of 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane?
9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane has a molecular weight of 196.29 g/mol, XLogP of 0.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-cyclopropyl-1-oxa-4,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 66661077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).