4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene

C14H21NO — CID 143782126

IUPAC4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene
SMILESC=CC1=C(/C=C\C)OCC12CCN(C)CC2
InChIInChI=1S/C14H21NO/c1-4-6-13-12(5-2)14(11-16-13)7-9-15(3)10-8-14/h4-6H,2,7-11H2,1,3H3/b6-4-
InChIKeyXYLMGUATVVKCMQ-XQRVVYSFSA-N
MW219.33 g/mol
LogP2.74
Rot. Bonds2

About 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene

4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene (PubChem CID 143782126) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene.

Molecular Properties

Compound Name4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene
PubChem CID143782126
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene
SMILESC=CC1=C(/C=C\C)OCC12CCN(C)CC2
InChIInChI=1S/C14H21NO/c1-4-6-13-12(5-2)14(11-16-13)7-9-15(3)10-8-14/h4-6H,2,7-11H2,1,3H3/b6-4-
InChIKeyXYLMGUATVVKCMQ-XQRVVYSFSA-N
XLogP2.74
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-cyclohexyl-3-[(1Z,3E)-3-fluoropenta-1,3-dienyl]-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 89344837
4-[[(2E,4E,6E)-4-fluoro-8-methylnona-2,4,6-trien-3-yl]oxymethyl]-1-methylpiperidine
CID 142399915
1',6-dimethylspiro[6,7-dihydro-2H-1-benzofuran-3,4'-piperidine]
CID 91216749
3,4-Bis(ethenyl)-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 123188135
3-[(Z)-3-bromobut-1-enyl]-4-ethenyl-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 126711147
8-ethyl-2-methyl-3,4-bis[(Z)-prop-1-enyl]-1-oxa-8-azaspiro[4.5]dec-3-ene
CID 130220142
4-[2-[(2E,4Z)-hexa-2,4-dien-3-yl]oxyethyl]-1-(4-methyl-2-methylidenepent-3-enyl)-4-[1-[(2-methylpropan-2-yl)oxy]ethenyl]piperidine
CID 132058932
4-[(1Z)-buta-1,3-dienyl]-8-methyl-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 134365723
Ethane;3-ethenyl-4,8-dimethyl-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 141882834
Buta-1,3-diene;ethane;3,4,8-trimethyl-2-oxa-8-azaspiro[4.5]dec-3-ene
CID 141882875
Ethane;3-ethyl-4,8-dimethyl-2-oxa-8-azaspiro[4.5]dec-3-ene;prop-1-ene
CID 141899778
4-Ethenyl-3,8-dimethyl-2-oxa-8-azaspiro[4.5]dec-3-ene;prop-1-ene
CID 143782132

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene?
The IUPAC name of 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene (CID 143782126) is 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene.
What is the SMILES notation for 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene?
The canonical SMILES for 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene is C=CC1=C(/C=C\C)OCC12CCN(C)CC2.
What is the InChIKey of 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene?
The InChIKey is XYLMGUATVVKCMQ-XQRVVYSFSA-N. The full InChI is InChI=1S/C14H21NO/c1-4-6-13-12(5-2)14(11-16-13)7-9-15(3)10-8-14/h4-6H,2,7-11H2,1,3H3/b6-4-.
What are the key properties of 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene?
4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene has a molecular weight of 219.33 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-8-methyl-3-[(Z)-prop-1-enyl]-2-oxa-8-azaspiro[4.5]dec-3-ene is sourced from PubChem (CID 143782126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).