2-(6-oxaspiro[4.5]decan-9-yl)ethanamine

C11H21NO — CID 79920888

IUPAC2-(6-oxaspiro[4.5]decan-9-yl)ethanamine
SMILESNCCC1CCOC2(CCCC2)C1
InChIInChI=1S/C11H21NO/c12-7-3-10-4-8-13-11(9-10)5-1-2-6-11/h10H,1-9,12H2
InChIKeyYVEKAHGNMUCCFT-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.07
Rot. Bonds2

About 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine

2-(6-oxaspiro[4.5]decan-9-yl)ethanamine (PubChem CID 79920888) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine.

Molecular Properties

Compound Name2-(6-oxaspiro[4.5]decan-9-yl)ethanamine
PubChem CID79920888
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-(6-oxaspiro[4.5]decan-9-yl)ethanamine
SMILESNCCC1CCOC2(CCCC2)C1
InChIInChI=1S/C11H21NO/c12-7-3-10-4-8-13-11(9-10)5-1-2-6-11/h10H,1-9,12H2
InChIKeyYVEKAHGNMUCCFT-UHFFFAOYSA-N
XLogP2.07
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The IUPAC name of 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine (CID 79920888) is 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine.
What is the SMILES notation for 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The canonical SMILES for 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine is NCCC1CCOC2(CCCC2)C1.
What is the InChIKey of 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The InChIKey is YVEKAHGNMUCCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c12-7-3-10-4-8-13-11(9-10)5-1-2-6-11/h10H,1-9,12H2.
What are the key properties of 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
2-(6-oxaspiro[4.5]decan-9-yl)ethanamine has a molecular weight of 183.29 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-oxaspiro[4.5]decan-9-yl)ethanamine is sourced from PubChem (CID 79920888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).