(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine

C16H14F2N2 — CID 139167712

IUPAC(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine
SMILESFc1cccc(C2=NN[C@@H](c3cccc(F)c3)CC2)c1
InChIInChI=1S/C16H14F2N2/c17-13-5-1-3-11(9-13)15-7-8-16(20-19-15)12-4-2-6-14(18)10-12/h1-6,9-10,15,19H,7-8H2/t15-/m1/s1
InChIKeyCZVRAECHPGIJON-OAHLLOKOSA-N
MW272.30 g/mol
LogP3.79
Rot. Bonds2

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

(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine (PubChem CID 139167712) has the molecular formula C16H14F2N2 and a molecular weight of 272.30 g/mol. Its IUPAC name is (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine.

Molecular Properties

Compound Name(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine
PubChem CID139167712
Molecular FormulaC16H14F2N2
Molecular Weight272.30 g/mol
Exact Mass272.11
IUPAC Name(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine
SMILESFc1cccc(C2=NN[C@@H](c3cccc(F)c3)CC2)c1
InChIInChI=1S/C16H14F2N2/c17-13-5-1-3-11(9-13)15-7-8-16(20-19-15)12-4-2-6-14(18)10-12/h1-6,9-10,15,19H,7-8H2/t15-/m1/s1
InChIKeyCZVRAECHPGIJON-OAHLLOKOSA-N
XLogP3.79
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The IUPAC name of (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine (CID 139167712) is (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine.
What is the SMILES notation for (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The canonical SMILES for (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine is Fc1cccc(C2=NN[C@@H](c3cccc(F)c3)CC2)c1.
What is the InChIKey of (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The InChIKey is CZVRAECHPGIJON-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H14F2N2/c17-13-5-1-3-11(9-13)15-7-8-16(20-19-15)12-4-2-6-14(18)10-12/h1-6,9-10,15,19H,7-8H2/t15-/m1/s1.
What are the key properties of (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
(6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine has a molecular weight of 272.30 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-3,6-bis(3-fluorophenyl)-1,4,5,6-tetrahydropyridazine is sourced from PubChem (CID 139167712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).