3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine

C11H14N2O — CID 10702855

IUPAC3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine
SMILESCOc1ccc(C2=NNCCC2)cc1
InChIInChI=1S/C11H14N2O/c1-14-10-6-4-9(5-7-10)11-3-2-8-12-13-11/h4-7,12H,2-3,8H2,1H3
InChIKeyIUQIBSUGVWFPTJ-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.78
Rot. Bonds2

About 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine

3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine (PubChem CID 10702855) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine
PubChem CID10702855
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine
SMILESCOc1ccc(C2=NNCCC2)cc1
InChIInChI=1S/C11H14N2O/c1-14-10-6-4-9(5-7-10)11-3-2-8-12-13-11/h4-7,12H,2-3,8H2,1H3
InChIKeyIUQIBSUGVWFPTJ-UHFFFAOYSA-N
XLogP1.78
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine?
The IUPAC name of 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine (CID 10702855) is 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine.
What is the SMILES notation for 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine?
The canonical SMILES for 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine is COc1ccc(C2=NNCCC2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine?
The InChIKey is IUQIBSUGVWFPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-14-10-6-4-9(5-7-10)11-3-2-8-12-13-11/h4-7,12H,2-3,8H2,1H3.
What are the key properties of 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine?
3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine has a molecular weight of 190.25 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-1,4,5,6-tetrahydropyridazine is sourced from PubChem (CID 10702855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).