1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine

C11H22N2O — CID 69004966

IUPAC1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine
SMILESCC(N)CN1CCC2(CCOC2)CC1
InChIInChI=1S/C11H22N2O/c1-10(12)8-13-5-2-11(3-6-13)4-7-14-9-11/h10H,2-9,12H2,1H3
InChIKeyZLLRUYJJIBVKQQ-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.84
Rot. Bonds2

About 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine

1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine (PubChem CID 69004966) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine
PubChem CID69004966
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine
SMILESCC(N)CN1CCC2(CCOC2)CC1
InChIInChI=1S/C11H22N2O/c1-10(12)8-13-5-2-11(3-6-13)4-7-14-9-11/h10H,2-9,12H2,1H3
InChIKeyZLLRUYJJIBVKQQ-UHFFFAOYSA-N
XLogP0.84
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine?
The IUPAC name of 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine (CID 69004966) is 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine.
What is the SMILES notation for 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine?
The canonical SMILES for 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine is CC(N)CN1CCC2(CCOC2)CC1.
What is the InChIKey of 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine?
The InChIKey is ZLLRUYJJIBVKQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-10(12)8-13-5-2-11(3-6-13)4-7-14-9-11/h10H,2-9,12H2,1H3.
What are the key properties of 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine?
1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine has a molecular weight of 198.31 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-oxa-8-azaspiro[4.5]decan-8-yl)propan-2-amine is sourced from PubChem (CID 69004966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).