6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine

C18H16N2 — CID 58254690

IUPAC6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine
SMILESC=C1C=CC(c2ccc(-c3ccccc3)c(C)c2)=NN1
InChIInChI=1S/C18H16N2/c1-13-12-16(18-11-8-14(2)19-20-18)9-10-17(13)15-6-4-3-5-7-15/h3-12,19H,2H2,1H3
InChIKeyUXJZVWSGPHURCE-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.04
Rot. Bonds2

About 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine

6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine (PubChem CID 58254690) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine.

Molecular Properties

Compound Name6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine
PubChem CID58254690
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine
SMILESC=C1C=CC(c2ccc(-c3ccccc3)c(C)c2)=NN1
InChIInChI=1S/C18H16N2/c1-13-12-16(18-11-8-14(2)19-20-18)9-10-17(13)15-6-4-3-5-7-15/h3-12,19H,2H2,1H3
InChIKeyUXJZVWSGPHURCE-UHFFFAOYSA-N
XLogP4.04
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine?
The IUPAC name of 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine (CID 58254690) is 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine.
What is the SMILES notation for 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine?
The canonical SMILES for 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine is C=C1C=CC(c2ccc(-c3ccccc3)c(C)c2)=NN1.
What is the InChIKey of 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine?
The InChIKey is UXJZVWSGPHURCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-13-12-16(18-11-8-14(2)19-20-18)9-10-17(13)15-6-4-3-5-7-15/h3-12,19H,2H2,1H3.
What are the key properties of 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine?
6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine has a molecular weight of 260.34 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-3-(3-methyl-4-phenylphenyl)-1H-pyridazine is sourced from PubChem (CID 58254690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).