[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine

C14H14N4O — CID 82381282

IUPAC[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine
SMILESCOc1ccc(-c2ccc3c(CN)ncn3n2)cc1
InChIInChI=1S/C14H14N4O/c1-19-11-4-2-10(3-5-11)12-6-7-14-13(8-15)16-9-18(14)17-12/h2-7,9H,8,15H2,1H3
InChIKeyGXOAVBBEAUWQJZ-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.86
Rot. Bonds3

About [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine

[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine (PubChem CID 82381282) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine.

Molecular Properties

Compound Name[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine
PubChem CID82381282
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine
SMILESCOc1ccc(-c2ccc3c(CN)ncn3n2)cc1
InChIInChI=1S/C14H14N4O/c1-19-11-4-2-10(3-5-11)12-6-7-14-13(8-15)16-9-18(14)17-12/h2-7,9H,8,15H2,1H3
InChIKeyGXOAVBBEAUWQJZ-UHFFFAOYSA-N
XLogP1.86
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-bromo-6-(4-methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]methanamine
CID 116821814
[1-ethyl-3-(4-methoxyphenyl)pyrazol-5-yl]methanamine
CID 84761591
[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]methanamine;hydrochloride
CID 82020599
4-[4-(4-methoxyphenyl)imidazol-1-yl]butan-1-amine
CID 18694797
ethyl (2S)-2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]propanoate
CID 7660048
1-(chloromethyl)-4-(4-methoxyphenyl)imidazole
CID 53415933
[2-(4-methoxyphenyl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 82285142
ethyl (2S)-2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]butanoate
CID 7660049
5-[4-(4-methoxyphenyl)phenyl]pyrazin-2-amine
CID 25140980
[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]methanamine
CID 54851145
5-(4-methoxyphenyl)pyrazine-2-carbonitrile
CID 19381792
[2-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-6-yl]methanamine
CID 82484599

Frequently Asked Questions

What is the IUPAC name of [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine?
The IUPAC name of [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine (CID 82381282) is [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine.
What is the SMILES notation for [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine?
The canonical SMILES for [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine is COc1ccc(-c2ccc3c(CN)ncn3n2)cc1.
What is the InChIKey of [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine?
The InChIKey is GXOAVBBEAUWQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-19-11-4-2-10(3-5-11)12-6-7-14-13(8-15)16-9-18(14)17-12/h2-7,9H,8,15H2,1H3.
What are the key properties of [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine?
[2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine has a molecular weight of 254.29 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methoxyphenyl)imidazo[1,5-b]pyridazin-5-yl]methanamine is sourced from PubChem (CID 82381282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).