6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine

C13H19N3O — CID 121202344

IUPAC6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine
SMILESNc1ccc(N2CCC3(CCCCO3)C2)nc1
InChIInChI=1S/C13H19N3O/c14-11-3-4-12(15-9-11)16-7-6-13(10-16)5-1-2-8-17-13/h3-4,9H,1-2,5-8,10,14H2
InChIKeyRTLBHRHEMRAJIP-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.81
Rot. Bonds1

About 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine

6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine (PubChem CID 121202344) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine
PubChem CID121202344
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine
SMILESNc1ccc(N2CCC3(CCCCO3)C2)nc1
InChIInChI=1S/C13H19N3O/c14-11-3-4-12(15-9-11)16-7-6-13(10-16)5-1-2-8-17-13/h3-4,9H,1-2,5-8,10,14H2
InChIKeyRTLBHRHEMRAJIP-UHFFFAOYSA-N
XLogP1.81
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine?
The IUPAC name of 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine (CID 121202344) is 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine?
The canonical SMILES for 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine is Nc1ccc(N2CCC3(CCCCO3)C2)nc1.
What is the InChIKey of 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine?
The InChIKey is RTLBHRHEMRAJIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c14-11-3-4-12(15-9-11)16-7-6-13(10-16)5-1-2-8-17-13/h3-4,9H,1-2,5-8,10,14H2.
What are the key properties of 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine?
6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine has a molecular weight of 233.31 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-oxa-2-azaspiro[4.5]decan-2-yl)pyridin-3-amine is sourced from PubChem (CID 121202344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).