2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine

C14H21N3O — CID 114196245

IUPAC2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine
SMILESCOc1ccc(N)c(N2CC3CCCC(C3)C2)n1
InChIInChI=1S/C14H21N3O/c1-18-13-6-5-12(15)14(16-13)17-8-10-3-2-4-11(7-10)9-17/h5-6,10-11H,2-4,7-9,15H2,1H3
InChIKeyHDZPSKTZGBPHQO-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.30
Rot. Bonds2

About 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine

2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine (PubChem CID 114196245) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine.

Molecular Properties

Compound Name2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine
PubChem CID114196245
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine
SMILESCOc1ccc(N)c(N2CC3CCCC(C3)C2)n1
InChIInChI=1S/C14H21N3O/c1-18-13-6-5-12(15)14(16-13)17-8-10-3-2-4-11(7-10)9-17/h5-6,10-11H,2-4,7-9,15H2,1H3
InChIKeyHDZPSKTZGBPHQO-UHFFFAOYSA-N
XLogP2.30
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-amino-6-methoxy-2-pyridinyl)pyrrolidine-3,4-diol
CID 106667349
5-amino-6-(3-azabicyclo[3.3.1]nonan-3-yl)pyridine-2-carboxylic acid
CID 114196709
6-methoxy-2-[3-(trifluoromethyl)piperidin-1-yl]pyridin-3-amine
CID 115320894
6-methoxy-2-(4-propan-2-ylazepan-1-yl)pyridin-3-amine
CID 115320844
6-methoxy-2-(4-methylsulfanylazepan-1-yl)pyridin-3-amine
CID 114236704
1-(3-amino-6-methoxy-2-pyridinyl)-4-methylpiperidin-4-ol
CID 115320981
2-(4-tert-butylpiperazin-1-yl)-6-methoxypyridin-3-amine
CID 115320517
2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-6-methoxypyridin-3-amine
CID 115320628
6-methoxy-2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridin-3-amine
CID 115320947
2-cyclohexyloxy-6-methoxypyridin-3-amine
CID 115321023
2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-6-methoxypyridin-3-amine
CID 113286582
2-(3-azabicyclo[3.3.1]nonan-3-yl)-5-chloropyridin-3-amine
CID 114196253

Frequently Asked Questions

What is the IUPAC name of 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine?
The IUPAC name of 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine (CID 114196245) is 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine.
What is the SMILES notation for 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine?
The canonical SMILES for 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine is COc1ccc(N)c(N2CC3CCCC(C3)C2)n1.
What is the InChIKey of 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine?
The InChIKey is HDZPSKTZGBPHQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-18-13-6-5-12(15)14(16-13)17-8-10-3-2-4-11(7-10)9-17/h5-6,10-11H,2-4,7-9,15H2,1H3.
What are the key properties of 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine?
2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine has a molecular weight of 247.34 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine is sourced from PubChem (CID 114196245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).