4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine

C8H7FN4 — CID 90328479

IUPAC4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine
SMILESCc1nn(-c2ccnnc2)cc1F
InChIInChI=1S/C8H7FN4/c1-6-8(9)5-13(12-6)7-2-3-10-11-4-7/h2-5H,1H3
InChIKeyNJZRTKCJJKLNNY-UHFFFAOYSA-N
MW178.17 g/mol
LogP1.11
Rot. Bonds1

About 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine

4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine (PubChem CID 90328479) has the molecular formula C8H7FN4 and a molecular weight of 178.17 g/mol. Its IUPAC name is 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine.

Molecular Properties

Compound Name4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine
PubChem CID90328479
Molecular FormulaC8H7FN4
Molecular Weight178.17 g/mol
Exact Mass178.07
IUPAC Name4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine
SMILESCc1nn(-c2ccnnc2)cc1F
InChIInChI=1S/C8H7FN4/c1-6-8(9)5-13(12-6)7-2-3-10-11-4-7/h2-5H,1H3
InChIKeyNJZRTKCJJKLNNY-UHFFFAOYSA-N
XLogP1.11
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.17
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Pyrazolo[1,5-a]pyrazine
CID 21873758
5-(3-Ethylpyrazol-1-yl)-3-(trifluoromethyl)pyridazine
CID 90247291
5-(3-Methylpyrazol-1-yl)-3-(trifluoromethyl)pyridazine
CID 90251325
4-(3-bromo-4-fluoro-1H-pyrazol-1-yl)pyridazine
CID 90319461
5-(4-Fluoro-3-methylpyrazol-1-yl)-3-(trifluoromethyl)pyridazine
CID 90328460
3-Chloro-5-(4-fluoro-3-methylpyrazol-1-yl)pyridazine
CID 156221193
1-Pyridazin-4-yl-5-(trifluoromethyl)pyrazol-4-amine;hydrochloride
CID 169213467
1-(Difluoromethyl)-4-(3-methylpyrazol-1-yl)pyrazole
CID 169595075
7-Fluoropyrazolo[1,5-a]pyrazine
CID 176894498
7-(Trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 176894499
Ethane;6-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 177972712
4-Pyrrolidin-1-ylpyridazine
CID 12449299

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine?
The IUPAC name of 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine (CID 90328479) is 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine.
What is the SMILES notation for 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine?
The canonical SMILES for 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine is Cc1nn(-c2ccnnc2)cc1F.
What is the InChIKey of 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine?
The InChIKey is NJZRTKCJJKLNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN4/c1-6-8(9)5-13(12-6)7-2-3-10-11-4-7/h2-5H,1H3.
What are the key properties of 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine?
4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine has a molecular weight of 178.17 g/mol, XLogP of 1.11, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoro-3-methylpyrazol-1-yl)pyridazine is sourced from PubChem (CID 90328479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).