3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene

C11H18N2O2 — CID 105464194

IUPAC3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
SMILESC1CC2(CCN1)CC(OCC1CC1)=NO2
InChIInChI=1S/C11H18N2O2/c1-2-9(1)8-14-10-7-11(15-13-10)3-5-12-6-4-11/h9,12H,1-8H2
InChIKeyIBEGWJPDWOCSTO-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.27
Rot. Bonds2

About 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene

3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene (PubChem CID 105464194) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
PubChem CID105464194
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene
SMILESC1CC2(CCN1)CC(OCC1CC1)=NO2
InChIInChI=1S/C11H18N2O2/c1-2-9(1)8-14-10-7-11(15-13-10)3-5-12-6-4-11/h9,12H,1-8H2
InChIKeyIBEGWJPDWOCSTO-UHFFFAOYSA-N
XLogP1.27
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The IUPAC name of 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene (CID 105464194) is 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene.
What is the SMILES notation for 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The canonical SMILES for 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene is C1CC2(CCN1)CC(OCC1CC1)=NO2.
What is the InChIKey of 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
The InChIKey is IBEGWJPDWOCSTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-9(1)8-14-10-7-11(15-13-10)3-5-12-6-4-11/h9,12H,1-8H2.
What are the key properties of 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene?
3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene has a molecular weight of 210.28 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)-1-oxa-2,8-diazaspiro[4.5]dec-2-ene is sourced from PubChem (CID 105464194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).