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

C13H24N2O — CID 64834063

IUPAC9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESC1COC(CN2CCNC3(CCCC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-2-6-13(5-1)11-15(8-7-14-13)10-12-4-3-9-16-12/h12,14H,1-11H2
InChIKeyPGOIRTDDCFKMNK-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.38
Rot. Bonds2

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

9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64834063) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64834063
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESC1COC(CN2CCNC3(CCCC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-2-6-13(5-1)11-15(8-7-14-13)10-12-4-3-9-16-12/h12,14H,1-11H2
InChIKeyPGOIRTDDCFKMNK-UHFFFAOYSA-N
XLogP1.38
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane (CID 64834063) is 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane is C1COC(CN2CCNC3(CCCC3)C2)C1.
What is the InChIKey of 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is PGOIRTDDCFKMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-6-13(5-1)11-15(8-7-14-13)10-12-4-3-9-16-12/h12,14H,1-11H2.
What are the key properties of 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 224.35 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(oxolan-2-ylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64834063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).