4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene

C9H15NO — CID 172575301

IUPAC4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene
SMILESCC1=CCOC12CCNCC2
InChIInChI=1S/C9H15NO/c1-8-2-7-11-9(8)3-5-10-6-4-9/h2,10H,3-7H2,1H3
InChIKeyAHIKLNVSOBDIFX-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.09
Rot. Bonds

About 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene

4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene (PubChem CID 172575301) has the molecular formula C9H15NO and a molecular weight of 153.23 g/mol. Its IUPAC name is 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene.

Molecular Properties

Compound Name4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene
PubChem CID172575301
Molecular FormulaC9H15NO
Molecular Weight153.23 g/mol
Exact Mass153.12
IUPAC Name4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene
SMILESCC1=CCOC12CCNCC2
InChIInChI=1S/C9H15NO/c1-8-2-7-11-9(8)3-5-10-6-4-9/h2,10H,3-7H2,1H3
InChIKeyAHIKLNVSOBDIFX-UHFFFAOYSA-N
XLogP1.09
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(2,5-dimethylphenyl)-4-fluoropiperidine
CID 112563134
6-methylspiro[1H-2-benzofuran-3,4'-piperidine];hydrochloride
CID 69267820
2-methylspiro[5H-furo[3,4-b]pyridine-7,4'-piperidine]
CID 118174279
4-fluoro-4-(2,4,5-trimethylphenyl)piperidine
CID 112563237
ethane;spiro[1H-2-benzofuran-3,4'-piperidine]
CID 163403209
3,3-dimethyl-2,4-dioxa-9-azaspiro[5.5]undecane
CID 82655471
6,7-dimethylspiro[2-benzofuran-3,4'-piperidine]-1-one
CID 91492916
6-methylspiro[1H-2-benzofuran-3,3'-pyrrolidine]
CID 84662082
2-methyl-1-oxa-8-azaspiro[4.5]decan-4-one
CID 10464720
4-(furan-2-yl)-4-methylpiperidine
CID 83815867
1-oxa-3,8-diazaspiro[4.5]dec-2-en-4-one
CID 154147627
(3-methylspiro[6,7-dihydropyrazolo[5,1-c][1,4]oxazine-4,4'-piperidine]-7-yl)methanol
CID 172575316

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene?
The IUPAC name of 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene (CID 172575301) is 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene.
What is the SMILES notation for 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene?
The canonical SMILES for 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene is CC1=CCOC12CCNCC2.
What is the InChIKey of 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene?
The InChIKey is AHIKLNVSOBDIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-8-2-7-11-9(8)3-5-10-6-4-9/h2,10H,3-7H2,1H3.
What are the key properties of 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene?
4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene has a molecular weight of 153.23 g/mol, XLogP of 1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-oxa-8-azaspiro[4.5]dec-3-ene is sourced from PubChem (CID 172575301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).