3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene

C11H19NO — CID 145031956

IUPAC3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
SMILESCC(C)C1=NOC2(CCCCC2)C1
InChIInChI=1S/C11H19NO/c1-9(2)10-8-11(13-12-10)6-4-3-5-7-11/h9H,3-8H2,1-2H3
InChIKeyDYWYBTNEPWDOEO-UHFFFAOYSA-N
MW181.28 g/mol
LogP3.12
Rot. Bonds1

About 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene

3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene (PubChem CID 145031956) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene.

Molecular Properties

Compound Name3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
PubChem CID145031956
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene
SMILESCC(C)C1=NOC2(CCCCC2)C1
InChIInChI=1S/C11H19NO/c1-9(2)10-8-11(13-12-10)6-4-3-5-7-11/h9H,3-8H2,1-2H3
InChIKeyDYWYBTNEPWDOEO-UHFFFAOYSA-N
XLogP3.12
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(6E,10E)-N,N'-dihydroxy-3-methyl-1-oxa-2-azaspiro[4.5]dec-2-ene-6,10-diimine
CID 9571901
3-Tert-butyl-8,8-difluoro-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 169041604
8-Fluoro-3,8-dimethyl-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 170219147
8,8-Difluoro-3-methyl-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 170219286
5,5-dimethyl-3-pentyl-4H-1,2-oxazole
CID 178337491
N-(6-hydroxyimino-3-methyl-1-oxa-2-azaspiro[4.5]dec-2-en-10-ylidene)hydroxylamine
CID 382420
2-Methyl-4-oxa-3-azaspiro[4.5]dec-2-ene-6,10-dione oxime
CID 5416060
3-Tert-butyl-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 13296101
3-Methyl-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 20644758
3-Methyl-1-oxa-2-azaspiro[4.6]undec-2-ene
CID 20644760
5-methyl-3,5-di(propan-2-yl)-4H-1,2-oxazole
CID 20718859
8-Tert-butyl-3-methyl-1-oxa-2-azaspiro[4.5]dec-2-ene
CID 57742210

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The IUPAC name of 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene (CID 145031956) is 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene.
What is the SMILES notation for 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The canonical SMILES for 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene is CC(C)C1=NOC2(CCCCC2)C1.
What is the InChIKey of 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
The InChIKey is DYWYBTNEPWDOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-9(2)10-8-11(13-12-10)6-4-3-5-7-11/h9H,3-8H2,1-2H3.
What are the key properties of 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene?
3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene has a molecular weight of 181.28 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-1-oxa-2-azaspiro[4.5]dec-2-ene is sourced from PubChem (CID 145031956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).