1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium

C11H14N5O+ — CID 171813889

IUPAC1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium
SMILESCOc1ccc(-c2nccnc2C(C)[NH3+])nn1
InChIInChI=1S/C11H13N5O/c1-7(12)10-11(14-6-5-13-10)8-3-4-9(17-2)16-15-8/h3-7H,12H2,1-2H3/p+1
InChIKeyLUCAPLMPLWMZCM-UHFFFAOYSA-O
MW232.27 g/mol
LogP0.25
Rot. Bonds3

About 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium

1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium (PubChem CID 171813889) has the molecular formula C11H14N5O+ and a molecular weight of 232.27 g/mol. Its IUPAC name is 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium.

Molecular Properties

Compound Name1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium
PubChem CID171813889
Molecular FormulaC11H14N5O+
Molecular Weight232.27 g/mol
Exact Mass232.12
IUPAC Name1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium
SMILESCOc1ccc(-c2nccnc2C(C)[NH3+])nn1
InChIInChI=1S/C11H13N5O/c1-7(12)10-11(14-6-5-13-10)8-3-4-9(17-2)16-15-8/h3-7H,12H2,1-2H3/p+1
InChIKeyLUCAPLMPLWMZCM-UHFFFAOYSA-O
XLogP0.25
TPSA88.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.27
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-(6-ethoxypyridazin-3-yl)pyrazin-2-yl]ethanol
CID 171813872
1-[3-[6-(2,2-difluoroethoxy)pyridazin-3-yl]pyrazin-2-yl]ethanol
CID 171813868
2-[1-[3-(6-ethoxypyridazin-3-yl)pyrazin-2-yl]ethyl]isoindole-1,3-dione
CID 171813881
3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethyl]-5-(trifluoromethyl)benzamide
CID 171813894
3-methoxy-6-(6-methoxy-3-pyridinyl)pyridazine
CID 24851547
2-(6-methoxypyridazin-3-yl)-1H-imidazole-5-carbaldehyde
CID 103375390
2-[3-(6-methoxypyridazin-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 103372858
3-methoxy-6-[4-[(E)-prop-1-enyl]phenyl]pyridazine
CID 173227363
boric acid;3,6-dimethoxypyridazine
CID 139090617
3-(3,4-dichlorophenyl)-6-methoxypyridazine
CID 12833133
3-methoxy-6-(3-methyl-1,2,3,6-tetrahydropyridin-5-yl)pyridazine
CID 163238244
(1R)-1-(6-methoxypyridazin-3-yl)ethanamine
CID 69002716

Frequently Asked Questions

What is the IUPAC name of 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium?
The IUPAC name of 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium (CID 171813889) is 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium.
What is the SMILES notation for 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium?
The canonical SMILES for 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium is COc1ccc(-c2nccnc2C(C)[NH3+])nn1.
What is the InChIKey of 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium?
The InChIKey is LUCAPLMPLWMZCM-UHFFFAOYSA-O. The full InChI is InChI=1S/C11H13N5O/c1-7(12)10-11(14-6-5-13-10)8-3-4-9(17-2)16-15-8/h3-7H,12H2,1-2H3/p+1.
What are the key properties of 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium?
1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium has a molecular weight of 232.27 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(6-methoxypyridazin-3-yl)pyrazin-2-yl]ethylazanium is sourced from PubChem (CID 171813889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).