5-oxa-8-azaspiro[3.5]non-7-ene

C7H11NO — CID 123627438

IUPAC5-oxa-8-azaspiro[3.5]non-7-ene
SMILESC1=NCC2(CCC2)OC1
InChIInChI=1S/C7H11NO/c1-2-7(3-1)6-8-4-5-9-7/h4H,1-3,5-6H2
InChIKeyVVCNLMXKESYIAP-UHFFFAOYSA-N
MW125.17 g/mol
LogP1.01
Rot. Bonds

About 5-oxa-8-azaspiro[3.5]non-7-ene

5-oxa-8-azaspiro[3.5]non-7-ene (PubChem CID 123627438) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is 5-oxa-8-azaspiro[3.5]non-7-ene.

Molecular Properties

Compound Name5-oxa-8-azaspiro[3.5]non-7-ene
PubChem CID123627438
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name5-oxa-8-azaspiro[3.5]non-7-ene
SMILESC1=NCC2(CCC2)OC1
InChIInChI=1S/C7H11NO/c1-2-7(3-1)6-8-4-5-9-7/h4H,1-3,5-6H2
InChIKeyVVCNLMXKESYIAP-UHFFFAOYSA-N
XLogP1.01
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-oxaspiro[2.7]decane
CID 13240757
(5R,7S)-4,8-dioxadispiro[4.1.47.35]tetradecane
CID 101092010
1,8-dioxaspiro[2.6]nonane
CID 88652146
7-methyl-4-oxaspiro[2.5]oct-6-ene
CID 143164265
2,7-diazaspiro[4.5]dec-7-ene
CID 91049043
5-oxaspiro[3.4]octan-7-one
CID 122163504
5-oxaspiro[3.4]octan-7-amine;hydrochloride
CID 122156633
2-(5-oxaspiro[3.5]nonan-8-yl)-3,4-dihydro-1H-naphthalen-2-amine
CID 79908074
7,16-dioxatrispiro[5.1.1.510.28.26]nonadecane
CID 11817934
1-(6-oxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912854
(4R,6S)-4-ethyl-7-oxaspiro[5.6]dodec-9-ene
CID 125455009
7,8,10,11-tetraoxatrispiro[5.2.2.512.39.36]tricosane
CID 24939149

Frequently Asked Questions

What is the IUPAC name of 5-oxa-8-azaspiro[3.5]non-7-ene?
The IUPAC name of 5-oxa-8-azaspiro[3.5]non-7-ene (CID 123627438) is 5-oxa-8-azaspiro[3.5]non-7-ene.
What is the SMILES notation for 5-oxa-8-azaspiro[3.5]non-7-ene?
The canonical SMILES for 5-oxa-8-azaspiro[3.5]non-7-ene is C1=NCC2(CCC2)OC1.
What is the InChIKey of 5-oxa-8-azaspiro[3.5]non-7-ene?
The InChIKey is VVCNLMXKESYIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-2-7(3-1)6-8-4-5-9-7/h4H,1-3,5-6H2.
What are the key properties of 5-oxa-8-azaspiro[3.5]non-7-ene?
5-oxa-8-azaspiro[3.5]non-7-ene has a molecular weight of 125.17 g/mol, XLogP of 1.01, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxa-8-azaspiro[3.5]non-7-ene is sourced from PubChem (CID 123627438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).