3-[phenoxy(phenyl)methyl]pyridazine

C17H14N2O — CID 15684249

IUPAC3-[phenoxy(phenyl)methyl]pyridazine
SMILESc1ccc(OC(c2ccccc2)c2cccnn2)cc1
InChIInChI=1S/C17H14N2O/c1-3-8-14(9-4-1)17(16-12-7-13-18-19-16)20-15-10-5-2-6-11-15/h1-13,17H
InChIKeyDPWJTGSLMMCCSF-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.64
Rot. Bonds4

About 3-[phenoxy(phenyl)methyl]pyridazine

3-[phenoxy(phenyl)methyl]pyridazine (PubChem CID 15684249) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-[phenoxy(phenyl)methyl]pyridazine.

Molecular Properties

Compound Name3-[phenoxy(phenyl)methyl]pyridazine
PubChem CID15684249
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name3-[phenoxy(phenyl)methyl]pyridazine
SMILESc1ccc(OC(c2ccccc2)c2cccnn2)cc1
InChIInChI=1S/C17H14N2O/c1-3-8-14(9-4-1)17(16-12-7-13-18-19-16)20-15-10-5-2-6-11-15/h1-13,17H
InChIKeyDPWJTGSLMMCCSF-UHFFFAOYSA-N
XLogP3.64
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[phenoxy(phenyl)methyl]pyridazine?
The IUPAC name of 3-[phenoxy(phenyl)methyl]pyridazine (CID 15684249) is 3-[phenoxy(phenyl)methyl]pyridazine.
What is the SMILES notation for 3-[phenoxy(phenyl)methyl]pyridazine?
The canonical SMILES for 3-[phenoxy(phenyl)methyl]pyridazine is c1ccc(OC(c2ccccc2)c2cccnn2)cc1.
What is the InChIKey of 3-[phenoxy(phenyl)methyl]pyridazine?
The InChIKey is DPWJTGSLMMCCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-3-8-14(9-4-1)17(16-12-7-13-18-19-16)20-15-10-5-2-6-11-15/h1-13,17H.
What are the key properties of 3-[phenoxy(phenyl)methyl]pyridazine?
3-[phenoxy(phenyl)methyl]pyridazine has a molecular weight of 262.31 g/mol, XLogP of 3.64, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[phenoxy(phenyl)methyl]pyridazine is sourced from PubChem (CID 15684249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).