methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane

C14H23N3O — CID 118305615

IUPACmethane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane
SMILESC.Cc1cncc(OC2CCN3CCCC2C3)n1
InChIInChI=1S/C13H19N3O.CH4/c1-10-7-14-8-13(15-10)17-12-4-6-16-5-2-3-11(12)9-16;/h7-8,11-12H,2-6,9H2,1H3;1H4
InChIKeyLNLCZQDOIZPCAH-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.28
Rot. Bonds2

About methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane

methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane (PubChem CID 118305615) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane.

Molecular Properties

Compound Namemethane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane
PubChem CID118305615
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Namemethane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane
SMILESC.Cc1cncc(OC2CCN3CCCC2C3)n1
InChIInChI=1S/C13H19N3O.CH4/c1-10-7-14-8-13(15-10)17-12-4-6-16-5-2-3-11(12)9-16;/h7-8,11-12H,2-6,9H2,1H3;1H4
InChIKeyLNLCZQDOIZPCAH-UHFFFAOYSA-N
XLogP2.28
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4S,5S)-4-[[6-(4-methylphenyl)-3-pyridinyl]oxy]-1-azabicyclo[3.3.1]nonane
CID 11594725
4-[[5-(2-fluoro-4-methylphenyl)-2-pyridinyl]oxy]-1-azabicyclo[3.3.1]nonane
CID 66920896
5-[6-[[(4S,5S)-1-azabicyclo[3.3.1]nonan-4-yl]oxy]-3-pyridinyl]-1H-indole
CID 66921010
2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171700905
(3R)-3-(6-methylpyrazin-2-yl)-1-azabicyclo[2.2.1]heptane
CID 71458009
4-(6-methylpyrazin-2-yl)oxyoxolan-3-amine
CID 126954154
2-[[(4S)-1-azabicyclo[3.3.1]nonan-4-yl]oxy]-5-(4-chlorophenyl)-1,3-thiazole
CID 118305558
5-[6-(1-azabicyclo[3.3.1]nonan-4-yloxy)pyridazin-3-yl]-2,3-dimethyl-1H-indole
CID 66920894
2-methyl-5-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]-1,3,4-thiadiazole
CID 171701845
1-(azepan-1-yl)-2-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]ethanone
CID 171704153
2-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171702056
2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
CID 171701885

Frequently Asked Questions

What is the IUPAC name of methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane?
The IUPAC name of methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane (CID 118305615) is methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane.
What is the SMILES notation for methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane?
The canonical SMILES for methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane is C.Cc1cncc(OC2CCN3CCCC2C3)n1.
What is the InChIKey of methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane?
The InChIKey is LNLCZQDOIZPCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O.CH4/c1-10-7-14-8-13(15-10)17-12-4-6-16-5-2-3-11(12)9-16;/h7-8,11-12H,2-6,9H2,1H3;1H4.
What are the key properties of methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane?
methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane has a molecular weight of 249.36 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-(6-methylpyrazin-2-yl)oxy-1-azabicyclo[3.3.1]nonane is sourced from PubChem (CID 118305615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).