8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane

C18H34N2O — CID 65170578

IUPAC8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane
SMILESCC(C)(C)C1CN(CCC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C18H34N2O/c1-17(2,3)16-13-20(11-8-15-7-6-12-21-15)18(14-19-16)9-4-5-10-18/h15-16,19H,4-14H2,1-3H3
InChIKeyYIEIRDLGXBQFDE-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.19
Rot. Bonds3

About 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane

8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane (PubChem CID 65170578) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane
PubChem CID65170578
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane
SMILESCC(C)(C)C1CN(CCC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C18H34N2O/c1-17(2,3)16-13-20(11-8-15-7-6-12-21-15)18(14-19-16)9-4-5-10-18/h15-16,19H,4-14H2,1-3H3
InChIKeyYIEIRDLGXBQFDE-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-1-[2-(oxolan-2-yl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 65170538
8-cyclopropyl-8-methyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane
CID 65170634
8-tert-butyl-6-(2,2-difluoroethyl)-6,9-diazaspiro[4.5]decane
CID 64843228
5-tert-butyl-1-[2-(oxolan-2-yl)ethyl]-2-propan-2-ylpiperazine
CID 64947681
4-methyl-1-[2-[(2R)-oxolan-2-yl]ethyl]-1,4-diazaspiro[5.5]undecane
CID 124830077
8-methyl-6-(oxan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64844942
3-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64849737
8-tert-butyl-6-(thiophen-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64843223
5-cyclopropyl-2,2-diethyl-1-[2-(oxolan-2-yl)ethyl]piperazine
CID 65170489
2-cyclopropyl-2-methyl-1-[2-(oxolan-2-yl)ethyl]-5-propylpiperazine
CID 65170718
5-tert-butyl-2-methyl-1-(oxolan-2-ylmethyl)piperazine
CID 64841812
2-tert-butyl-5-methyl-1-[3-(oxolan-2-yl)propyl]piperazine
CID 65170275

Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane (CID 65170578) is 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane is CC(C)(C)C1CN(CCC2CCCO2)C2(CCCC2)CN1.
What is the InChIKey of 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane?
The InChIKey is YIEIRDLGXBQFDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-17(2,3)16-13-20(11-8-15-7-6-12-21-15)18(14-19-16)9-4-5-10-18/h15-16,19H,4-14H2,1-3H3.
What are the key properties of 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane?
8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane has a molecular weight of 294.48 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-6-[2-(oxolan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 65170578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).