8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine

C15H26N2O2 — CID 79902000

IUPAC8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2C1CCOC2(CCOC2)C1
InChIInChI=1S/C15H26N2O2/c16-11-7-12-1-2-13(8-11)17(12)14-3-5-19-15(9-14)4-6-18-10-15/h11-14H,1-10,16H2
InChIKeyIMNLYIMBCQFBLG-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.28
Rot. Bonds1

About 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine

8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 79902000) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID79902000
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2C1CCOC2(CCOC2)C1
InChIInChI=1S/C15H26N2O2/c16-11-7-12-1-2-13(8-11)17(12)14-3-5-19-15(9-14)4-6-18-10-15/h11-14H,1-10,16H2
InChIKeyIMNLYIMBCQFBLG-UHFFFAOYSA-N
XLogP1.28
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine with MolForge

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Related Compounds

(3S)-1-(2,6-dioxaspiro[4.5]decan-9-yl)pyrrolidin-3-amine
CID 115302425
8-(2,2-diethyloxan-4-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 83039128
[1-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-4-yl]methanol
CID 79919762
1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-ethylazetidin-3-amine
CID 79919359
[1-(2,6-dioxaspiro[4.5]decan-9-yl)pyrrolidin-2-yl]methanamine
CID 79919949
1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylazetidin-3-ol
CID 79919999
1-(1,9-dioxaspiro[5.5]undecan-4-yl)pyrrolidin-3-amine
CID 79901731
3-[1-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-4-yl]propanoic acid
CID 79901129
2-[1-(2,6-dioxaspiro[4.5]decan-9-yl)azetidin-3-yl]acetic acid
CID 79893611
1-(2,6-dioxaspiro[4.5]decan-9-yl)piperidine-2-carbonitrile
CID 79903946
[1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylpyrrolidin-2-yl]methanamine
CID 102784497
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine
CID 115300476

Frequently Asked Questions

What is the IUPAC name of 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine (CID 79902000) is 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine is NC1CC2CCC(C1)N2C1CCOC2(CCOC2)C1.
What is the InChIKey of 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is IMNLYIMBCQFBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c16-11-7-12-1-2-13(8-11)17(12)14-3-5-19-15(9-14)4-6-18-10-15/h11-14H,1-10,16H2.
What are the key properties of 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine?
8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 266.38 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,6-dioxaspiro[4.5]decan-9-yl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 79902000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).