3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine

C16H15FN2 — CID 169188790

IUPAC3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine
SMILESFc1ccc(C2=NNCCC2c2ccccc2)cc1
InChIInChI=1S/C16H15FN2/c17-14-8-6-13(7-9-14)16-15(10-11-18-19-16)12-4-2-1-3-5-12/h1-9,15,18H,10-11H2
InChIKeyDCTYELISVGBBTJ-UHFFFAOYSA-N
MW254.31 g/mol
LogP3.31
Rot. Bonds2

About 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine

3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine (PubChem CID 169188790) has the molecular formula C16H15FN2 and a molecular weight of 254.31 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine
PubChem CID169188790
Molecular FormulaC16H15FN2
Molecular Weight254.31 g/mol
Exact Mass254.12
IUPAC Name3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine
SMILESFc1ccc(C2=NNCCC2c2ccccc2)cc1
InChIInChI=1S/C16H15FN2/c17-14-8-6-13(7-9-14)16-15(10-11-18-19-16)12-4-2-1-3-5-12/h1-9,15,18H,10-11H2
InChIKeyDCTYELISVGBBTJ-UHFFFAOYSA-N
XLogP3.31
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine?
The IUPAC name of 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine (CID 169188790) is 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine.
What is the SMILES notation for 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine?
The canonical SMILES for 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine is Fc1ccc(C2=NNCCC2c2ccccc2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine?
The InChIKey is DCTYELISVGBBTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2/c17-14-8-6-13(7-9-14)16-15(10-11-18-19-16)12-4-2-1-3-5-12/h1-9,15,18H,10-11H2.
What are the key properties of 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine?
3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine has a molecular weight of 254.31 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-4-phenyl-1,4,5,6-tetrahydropyridazine is sourced from PubChem (CID 169188790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).