2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane

C19H37NO — CID 143979471

IUPAC2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane
SMILESC=CC1=C(C=C)OC2(CCN(C)CC2)C1.CC.CC.CC
InChIInChI=1S/C13H19NO.3C2H6/c1-4-11-10-13(15-12(11)5-2)6-8-14(3)9-7-13;3*1-2/h4-5H,1-2,6-10H2,3H3;3*1-2H3
InChIKeyNKOOFCINUZXHPT-UHFFFAOYSA-N
MW295.51 g/mol
LogP5.58
Rot. Bonds2

About 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane

2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane (PubChem CID 143979471) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane.

Molecular Properties

Compound Name2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane
PubChem CID143979471
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC Name2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane
SMILESC=CC1=C(C=C)OC2(CCN(C)CC2)C1.CC.CC.CC
InChIInChI=1S/C13H19NO.3C2H6/c1-4-11-10-13(15-12(11)5-2)6-8-14(3)9-7-13;3*1-2/h4-5H,1-2,6-10H2,3H3;3*1-2H3
InChIKeyNKOOFCINUZXHPT-UHFFFAOYSA-N
XLogP5.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.51
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane?
The IUPAC name of 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane (CID 143979471) is 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane.
What is the SMILES notation for 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane?
The canonical SMILES for 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane is C=CC1=C(C=C)OC2(CCN(C)CC2)C1.CC.CC.CC.
What is the InChIKey of 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane?
The InChIKey is NKOOFCINUZXHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO.3C2H6/c1-4-11-10-13(15-12(11)5-2)6-8-14(3)9-7-13;3*1-2/h4-5H,1-2,6-10H2,3H3;3*1-2H3.
What are the key properties of 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane?
2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane has a molecular weight of 295.51 g/mol, XLogP of 5.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-8-methyl-1-oxa-8-azaspiro[4.5]dec-2-ene;ethane is sourced from PubChem (CID 143979471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).