2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine

C11H15N3O — CID 66391110

IUPAC2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine
SMILESNc1cccnc1N1CC2CCC(C1)O2
InChIInChI=1S/C11H15N3O/c12-10-2-1-5-13-11(10)14-6-8-3-4-9(7-14)15-8/h1-2,5,8-9H,3-4,6-7,12H2
InChIKeyYHUFWGXZWZKVQD-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.03
Rot. Bonds1

About 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine

2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine (PubChem CID 66391110) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine
PubChem CID66391110
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine
SMILESNc1cccnc1N1CC2CCC(C1)O2
InChIInChI=1S/C11H15N3O/c12-10-2-1-5-13-11(10)14-6-8-3-4-9(7-14)15-8/h1-2,5,8-9H,3-4,6-7,12H2
InChIKeyYHUFWGXZWZKVQD-UHFFFAOYSA-N
XLogP1.03
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine?
The IUPAC name of 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine (CID 66391110) is 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine.
What is the SMILES notation for 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine?
The canonical SMILES for 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine is Nc1cccnc1N1CC2CCC(C1)O2.
What is the InChIKey of 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine?
The InChIKey is YHUFWGXZWZKVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-10-2-1-5-13-11(10)14-6-8-3-4-9(7-14)15-8/h1-2,5,8-9H,3-4,6-7,12H2.
What are the key properties of 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine?
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine has a molecular weight of 205.26 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridin-3-amine is sourced from PubChem (CID 66391110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).