7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine

C13H13N5O — CID 155539210

IUPAC7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
SMILESCCn1cnc2c(-c3ccnc(OC)c3)cnnc21
InChIInChI=1S/C13H13N5O/c1-3-18-8-15-12-10(7-16-17-13(12)18)9-4-5-14-11(6-9)19-2/h4-8H,3H2,1-2H3
InChIKeyZZZUWNYLFYIHHT-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.92
Rot. Bonds3

About 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine

7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine (PubChem CID 155539210) has the molecular formula C13H13N5O and a molecular weight of 255.28 g/mol. Its IUPAC name is 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine.

Molecular Properties

Compound Name7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
PubChem CID155539210
Molecular FormulaC13H13N5O
Molecular Weight255.28 g/mol
Exact Mass255.11
IUPAC Name7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
SMILESCCn1cnc2c(-c3ccnc(OC)c3)cnnc21
InChIInChI=1S/C13H13N5O/c1-3-18-8-15-12-10(7-16-17-13(12)18)9-4-5-14-11(6-9)19-2/h4-8H,3H2,1-2H3
InChIKeyZZZUWNYLFYIHHT-UHFFFAOYSA-N
XLogP1.92
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-Methyl-3-(4-methylpyridin-3-yl)-6-(pyridin-2-ylmethoxy)pyrazolo[3,4-b]pyrazine
CID 72165213
E-2212
CID 46854987
Ksq-4279
CID 150782011
Methyl substituted pyrazole, 27
CID 23648674
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
3-(6-Methoxypyridin-2-yl)-7-phenylimidazo[1,2-a]pyridine
CID 5329342
6-(4-Methoxyphenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine
CID 5329457
6-(4-Methoxyphenyl)-3-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidine
CID 5329458
N-(3-methoxyphenyl)-1-methyl-6-(4-methylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 16456451
1-Methyl-2-[4-(1-methyl-4-pyridin-4-yl-1H-pyrazol-3-yl)phenoxymethyl]-1H-benzoimidazole
CID 23648644
2-Methoxy-6,7-Dimethyl-9-(4-Methylpyridin-3-Yl)imidazo[1,5-A]pyrido[3,2-E]pyrazine
CID 42629702
7-(2-fluorophenyl)-2-((2-methyl-2H-1,2,4-triazol-3-yl)methoxy)-3-(pyridin-3-yl)pyrazolo[1,5-d][1,2,4]triazine
CID 18406917

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The IUPAC name of 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine (CID 155539210) is 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine.
What is the SMILES notation for 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The canonical SMILES for 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine is CCn1cnc2c(-c3ccnc(OC)c3)cnnc21.
What is the InChIKey of 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The InChIKey is ZZZUWNYLFYIHHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O/c1-3-18-8-15-12-10(7-16-17-13(12)18)9-4-5-14-11(6-9)19-2/h4-8H,3H2,1-2H3.
What are the key properties of 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine has a molecular weight of 255.28 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-(2-methoxy-4-pyridinyl)imidazo[4,5-c]pyridazine is sourced from PubChem (CID 155539210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).