8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane

C15H28N2O — CID 64840919

IUPAC8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C)CN(CC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C15H28N2O/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h13,16H,3-12H2,1-2H3
InChIKeyIZWZJPDEDHFWEA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.16
Rot. Bonds2

About 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane

8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64840919) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64840919
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESCC1(C)CN(CC2CCCO2)C2(CCCC2)CN1
InChIInChI=1S/C15H28N2O/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h13,16H,3-12H2,1-2H3
InChIKeyIZWZJPDEDHFWEA-UHFFFAOYSA-N
XLogP2.16
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane (CID 64840919) is 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane is CC1(C)CN(CC2CCCO2)C2(CCCC2)CN1.
What is the InChIKey of 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is IZWZJPDEDHFWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-14(2)12-17(10-13-6-5-9-18-13)15(11-16-14)7-3-4-8-15/h13,16H,3-12H2,1-2H3.
What are the key properties of 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 252.40 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-6-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64840919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).