2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane

C14H27NO — CID 58185248

IUPAC2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane
SMILESCC(C)C1CC2(CCCOC2)CN1C(C)C
InChIInChI=1S/C14H27NO/c1-11(2)13-8-14(6-5-7-16-10-14)9-15(13)12(3)4/h11-13H,5-10H2,1-4H3
InChIKeyZJEBMYKMZNDDNH-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.92
Rot. Bonds2

About 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane

2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane (PubChem CID 58185248) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane
PubChem CID58185248
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane
SMILESCC(C)C1CC2(CCCOC2)CN1C(C)C
InChIInChI=1S/C14H27NO/c1-11(2)13-8-14(6-5-7-16-10-14)9-15(13)12(3)4/h11-13H,5-10H2,1-4H3
InChIKeyZJEBMYKMZNDDNH-UHFFFAOYSA-N
XLogP2.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane?
The IUPAC name of 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane (CID 58185248) is 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane.
What is the SMILES notation for 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane?
The canonical SMILES for 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane is CC(C)C1CC2(CCCOC2)CN1C(C)C.
What is the InChIKey of 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane?
The InChIKey is ZJEBMYKMZNDDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11(2)13-8-14(6-5-7-16-10-14)9-15(13)12(3)4/h11-13H,5-10H2,1-4H3.
What are the key properties of 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane?
2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane has a molecular weight of 225.38 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(propan-2-yl)-7-oxa-2-azaspiro[4.5]decane is sourced from PubChem (CID 58185248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).