3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine

C11H8F3N3 — CID 168913034

IUPAC3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine
SMILESCc1ccc(-c2cnccc2C(F)(F)F)nn1
InChIInChI=1S/C11H8F3N3/c1-7-2-3-10(17-16-7)8-6-15-5-4-9(8)11(12,13)14/h2-6H,1H3
InChIKeyGCKNUUNLHZILCV-UHFFFAOYSA-N
MW239.20 g/mol
LogP2.87
Rot. Bonds1

About 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine

3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine (PubChem CID 168913034) has the molecular formula C11H8F3N3 and a molecular weight of 239.20 g/mol. Its IUPAC name is 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine.

Molecular Properties

Compound Name3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine
PubChem CID168913034
Molecular FormulaC11H8F3N3
Molecular Weight239.20 g/mol
Exact Mass239.07
IUPAC Name3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine
SMILESCc1ccc(-c2cnccc2C(F)(F)F)nn1
InChIInChI=1S/C11H8F3N3/c1-7-2-3-10(17-16-7)8-6-15-5-4-9(8)11(12,13)14/h2-6H,1H3
InChIKeyGCKNUUNLHZILCV-UHFFFAOYSA-N
XLogP2.87
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.20
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazin-3-yl]methanimine
CID 164557635
3-[4-(trifluoromethyl)-3-pyridinyl]-1H-pyridazin-6-one
CID 106522536
N,2-dimethyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-amine
CID 102709116
3-(4-fluoro-2-pyridinyl)-4-(trifluoromethyl)pyridine
CID 102824580
[3-methyl-4-[4-(trifluoromethyl)-3-pyridinyl]phenyl]methanamine
CID 102708695
N-[[4-[4-(trifluoromethyl)-3-pyridinyl]phenyl]methyl]propan-2-amine
CID 102708697
2-fluoro-5-[4-(trifluoromethyl)-3-pyridinyl]pyridine
CID 169408045
2,4-dimethyl-5-[4-(trifluoromethyl)-3-pyridinyl]benzoic acid
CID 107515751
2,5-dimethyl-6-[4-(trifluoromethyl)-3-pyridinyl]-1H-pyrimidine-4-thione
CID 106522562
2-[4-(trifluoromethyl)-3-pyridinyl]-1,3-benzothiazole
CID 69499454
4-[4-(trifluoromethyl)-3-pyridinyl]benzaldehyde
CID 102708678
4-(trifluoromethyl)pyridin-3-ol
CID 25210497

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine?
The IUPAC name of 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine (CID 168913034) is 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine.
What is the SMILES notation for 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine?
The canonical SMILES for 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine is Cc1ccc(-c2cnccc2C(F)(F)F)nn1.
What is the InChIKey of 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine?
The InChIKey is GCKNUUNLHZILCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N3/c1-7-2-3-10(17-16-7)8-6-15-5-4-9(8)11(12,13)14/h2-6H,1H3.
What are the key properties of 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine?
3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine has a molecular weight of 239.20 g/mol, XLogP of 2.87, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyridazine is sourced from PubChem (CID 168913034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).