2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane

C16H28N2 — CID 79678702

IUPAC2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane
SMILESC1CCCC2(CC1)CN(C1CC3CCC(C1)N3)C2
InChIInChI=1S/C16H28N2/c1-2-4-8-16(7-3-1)11-18(12-16)15-9-13-5-6-14(10-15)17-13/h13-15,17H,1-12H2
InChIKeyGFLOPWICDURZTC-UHFFFAOYSA-N
MW248.41 g/mol
LogP2.93
Rot. Bonds1

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane

2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane (PubChem CID 79678702) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane.

Molecular Properties

Compound Name2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane
PubChem CID79678702
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC Name2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane
SMILESC1CCCC2(CC1)CN(C1CC3CCC(C1)N3)C2
InChIInChI=1S/C16H28N2/c1-2-4-8-16(7-3-1)11-18(12-16)15-9-13-5-6-14(10-15)17-13/h13-15,17H,1-12H2
InChIKeyGFLOPWICDURZTC-UHFFFAOYSA-N
XLogP2.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane?
The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane (CID 79678702) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane.
What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane?
The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane is C1CCCC2(CC1)CN(C1CC3CCC(C1)N3)C2.
What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane?
The InChIKey is GFLOPWICDURZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2/c1-2-4-8-16(7-3-1)11-18(12-16)15-9-13-5-6-14(10-15)17-13/h13-15,17H,1-12H2.
What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane?
2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane has a molecular weight of 248.41 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-2-azaspiro[3.6]decane is sourced from PubChem (CID 79678702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).