3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine

C20H16N4O — CID 119066143

IUPAC3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine
SMILESCn1ccnc1-c1ccc(-c2ccc(Oc3ccccc3)cc2)nn1
InChIInChI=1S/C20H16N4O/c1-24-14-13-21-20(24)19-12-11-18(22-23-19)15-7-9-17(10-8-15)25-16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyRQKMDDAZJXCJRE-UHFFFAOYSA-N
MW328.38 g/mol
LogP4.34
Rot. Bonds4

About 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine

3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine (PubChem CID 119066143) has the molecular formula C20H16N4O and a molecular weight of 328.38 g/mol. Its IUPAC name is 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine.

Molecular Properties

Compound Name3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine
PubChem CID119066143
Molecular FormulaC20H16N4O
Molecular Weight328.38 g/mol
Exact Mass328.13
IUPAC Name3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine
SMILESCn1ccnc1-c1ccc(-c2ccc(Oc3ccccc3)cc2)nn1
InChIInChI=1S/C20H16N4O/c1-24-14-13-21-20(24)19-12-11-18(22-23-19)15-7-9-17(10-8-15)25-16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyRQKMDDAZJXCJRE-UHFFFAOYSA-N
XLogP4.34
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine
CID 162637660
ethane;1-methyl-2-phenylimidazole
CID 142155183
1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
CID 1088925
1-methyl-N-(4-phenoxyphenyl)imidazol-2-amine
CID 106556281
3-(1-methylimidazol-2-yl)-6-[3-(1H-pyrazol-5-yl)phenyl]pyridazine
CID 77084371
6-(1-methylimidazol-2-yl)-N-(2-pyridin-3-yloxypropyl)pyridazin-3-amine
CID 56739047
4-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]pyrrolidin-2-one
CID 155911763
[6-(4-phenoxyphenyl)pyridazin-3-yl]hydrazine
CID 10265556
1-methyl-2-[4-[4-(1-methylimidazol-2-yl)phenyl]phenyl]imidazole
CID 132575754
[1-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]-4-(2-phenoxyethyl)piperidin-4-yl]methanol
CID 56759030
3-(2-ethoxy-3-pyridinyl)-6-(1-methylimidazol-2-yl)pyridazine
CID 121497129
3-(1-methylimidazol-2-yl)-6-[3-[(1R)-1-pyrrolidin-1-ylethyl]phenyl]pyridazine
CID 126441558

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine?
The IUPAC name of 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine (CID 119066143) is 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine.
What is the SMILES notation for 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine?
The canonical SMILES for 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine is Cn1ccnc1-c1ccc(-c2ccc(Oc3ccccc3)cc2)nn1.
What is the InChIKey of 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine?
The InChIKey is RQKMDDAZJXCJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O/c1-24-14-13-21-20(24)19-12-11-18(22-23-19)15-7-9-17(10-8-15)25-16-5-3-2-4-6-16/h2-14H,1H3.
What are the key properties of 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine?
3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine has a molecular weight of 328.38 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine is sourced from PubChem (CID 119066143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).