3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane

C15H23N3O2 — CID 134078912

IUPAC3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane
SMILESCOCCC1COC2(CCN(c3cnccn3)CC2)C1
InChIInChI=1S/C15H23N3O2/c1-19-9-2-13-10-15(20-12-13)3-7-18(8-4-15)14-11-16-5-6-17-14/h5-6,11,13H,2-4,7-10,12H2,1H3
InChIKeyFVNLGXDHOQPMGO-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.89
Rot. Bonds4

About 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane

3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane (PubChem CID 134078912) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane
PubChem CID134078912
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane
SMILESCOCCC1COC2(CCN(c3cnccn3)CC2)C1
InChIInChI=1S/C15H23N3O2/c1-19-9-2-13-10-15(20-12-13)3-7-18(8-4-15)14-11-16-5-6-17-14/h5-6,11,13H,2-4,7-10,12H2,1H3
InChIKeyFVNLGXDHOQPMGO-UHFFFAOYSA-N
XLogP1.89
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane (CID 134078912) is 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane is COCCC1COC2(CCN(c3cnccn3)CC2)C1.
What is the InChIKey of 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is FVNLGXDHOQPMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-19-9-2-13-10-15(20-12-13)3-7-18(8-4-15)14-11-16-5-6-17-14/h5-6,11,13H,2-4,7-10,12H2,1H3.
What are the key properties of 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane?
3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 277.37 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-8-pyrazin-2-yl-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 134078912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).