8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

C15H20N2O3 — CID 170615066

IUPAC8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESc1cc(C2CCC3(CC2)OCCO3)c2c(n1)NCCO2
InChIInChI=1S/C15H20N2O3/c1-4-15(19-9-10-20-15)5-2-11(1)12-3-6-16-14-13(12)18-8-7-17-14/h3,6,11H,1-2,4-5,7-10H2,(H,16,17)
InChIKeyODOMYDYRGREFFW-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.29
Rot. Bonds1

About 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (PubChem CID 170615066) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound Name8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
PubChem CID170615066
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESc1cc(C2CCC3(CC2)OCCO3)c2c(n1)NCCO2
InChIInChI=1S/C15H20N2O3/c1-4-15(19-9-10-20-15)5-2-11(1)12-3-6-16-14-13(12)18-8-7-17-14/h3,6,11H,1-2,4-5,7-10H2,(H,16,17)
InChIKeyODOMYDYRGREFFW-UHFFFAOYSA-N
XLogP2.29
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The IUPAC name of 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (CID 170615066) is 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The canonical SMILES for 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is c1cc(C2CCC3(CC2)OCCO3)c2c(n1)NCCO2.
What is the InChIKey of 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The InChIKey is ODOMYDYRGREFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-4-15(19-9-10-20-15)5-2-11(1)12-3-6-16-14-13(12)18-8-7-17-14/h3,6,11H,1-2,4-5,7-10H2,(H,16,17).
What are the key properties of 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine has a molecular weight of 276.34 g/mol, XLogP of 2.29, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1,4-dioxaspiro[4.5]decan-8-yl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 170615066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).