3-methyl-5-(1H-pyrazol-5-yl)pyridazine

C8H8N4 — CID 130671625

IUPAC3-methyl-5-(1H-pyrazol-5-yl)pyridazine
SMILESCc1cc(-c2ccn[nH]2)cnn1
InChIInChI=1S/C8H8N4/c1-6-4-7(5-10-11-6)8-2-3-9-12-8/h2-5H,1H3,(H,9,12)
InChIKeyYMHPYNBWWVYCRL-UHFFFAOYSA-N
MW160.18 g/mol
LogP1.18
Rot. Bonds1

About 3-methyl-5-(1H-pyrazol-5-yl)pyridazine

3-methyl-5-(1H-pyrazol-5-yl)pyridazine (PubChem CID 130671625) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 3-methyl-5-(1H-pyrazol-5-yl)pyridazine.

Molecular Properties

Compound Name3-methyl-5-(1H-pyrazol-5-yl)pyridazine
PubChem CID130671625
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name3-methyl-5-(1H-pyrazol-5-yl)pyridazine
SMILESCc1cc(-c2ccn[nH]2)cnn1
InChIInChI=1S/C8H8N4/c1-6-4-7(5-10-11-6)8-2-3-9-12-8/h2-5H,1H3,(H,9,12)
InChIKeyYMHPYNBWWVYCRL-UHFFFAOYSA-N
XLogP1.18
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1H-pyrazol-5-yl)triazine
CID 173069530
5-(3,4-dimethylphenyl)-1H-pyrazole
CID 61395014
3-phenyl-5-(1H-pyrazol-5-yl)pyridine
CID 90751414
3-(1H-pyrazol-5-yl)quinoline
CID 22660698
2-propan-2-yl-5-(1H-pyrazol-5-yl)pyrimidine
CID 170448703
5-methyl-4-(1H-pyrazol-5-yl)-1H-pyrazole
CID 130918479
5-(4-chlorophenyl)-1H-pyrazole
CID 714291
5-(4-bromophenyl)-1H-pyrazole
CID 2735614
6-methoxy-3-(1H-pyrazol-5-yl)quinoline
CID 50962357
3,5-dimethyl-2-(1H-pyrazol-5-yl)pyridine;iridium
CID 159478462
5-(4-bromo-3,5-dimethoxyphenyl)-1H-pyrazole
CID 58432118
5-(3-propan-2-ylphenyl)-1H-pyrazole
CID 58101929

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(1H-pyrazol-5-yl)pyridazine?
The IUPAC name of 3-methyl-5-(1H-pyrazol-5-yl)pyridazine (CID 130671625) is 3-methyl-5-(1H-pyrazol-5-yl)pyridazine.
What is the SMILES notation for 3-methyl-5-(1H-pyrazol-5-yl)pyridazine?
The canonical SMILES for 3-methyl-5-(1H-pyrazol-5-yl)pyridazine is Cc1cc(-c2ccn[nH]2)cnn1.
What is the InChIKey of 3-methyl-5-(1H-pyrazol-5-yl)pyridazine?
The InChIKey is YMHPYNBWWVYCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c1-6-4-7(5-10-11-6)8-2-3-9-12-8/h2-5H,1H3,(H,9,12).
What are the key properties of 3-methyl-5-(1H-pyrazol-5-yl)pyridazine?
3-methyl-5-(1H-pyrazol-5-yl)pyridazine has a molecular weight of 160.18 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(1H-pyrazol-5-yl)pyridazine is sourced from PubChem (CID 130671625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).