5-(1H-pyrazol-5-yl)triazine

C6H5N5 — CID 173069530

IUPAC5-(1H-pyrazol-5-yl)triazine
SMILESc1cc(-c2cnnnc2)[nH]n1
InChIInChI=1S/C6H5N5/c1-2-7-10-6(1)5-3-8-11-9-4-5/h1-4H,(H,7,10)
InChIKeyCWUUCXVMTJIUJW-UHFFFAOYSA-N
MW147.14 g/mol
LogP0.26
Rot. Bonds1

About 5-(1H-pyrazol-5-yl)triazine

5-(1H-pyrazol-5-yl)triazine (PubChem CID 173069530) has the molecular formula C6H5N5 and a molecular weight of 147.14 g/mol. Its IUPAC name is 5-(1H-pyrazol-5-yl)triazine.

Molecular Properties

Compound Name5-(1H-pyrazol-5-yl)triazine
PubChem CID173069530
Molecular FormulaC6H5N5
Molecular Weight147.14 g/mol
Exact Mass147.05
IUPAC Name5-(1H-pyrazol-5-yl)triazine
SMILESc1cc(-c2cnnnc2)[nH]n1
InChIInChI=1S/C6H5N5/c1-2-7-10-6(1)5-3-8-11-9-4-5/h1-4H,(H,7,10)
InChIKeyCWUUCXVMTJIUJW-UHFFFAOYSA-N
XLogP0.26
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.14
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-5-(1H-pyrazol-5-yl)pyridazine
CID 130671625
2-propan-2-yl-5-(1H-pyrazol-5-yl)pyrimidine
CID 170448703
5-(4-chlorophenyl)-1H-pyrazole
CID 714291
5-(4-bromophenyl)-1H-pyrazole
CID 2735614
5-[4-[(E)-2-[4-(1H-pyrazol-5-yl)phenyl]ethenyl]phenyl]-1H-pyrazole
CID 70413640
3-phenyl-5-(1H-pyrazol-5-yl)pyridine
CID 90751414
5-(3,4-dimethylphenyl)-1H-pyrazole
CID 61395014
5-(4-phenylsulfanylphenyl)-1H-pyrazole
CID 1471991
5-[4-(1H-pyrazol-5-yl)phenyl]pyrazin-2-amine
CID 56718285
3-(1H-pyrazol-5-yl)quinoline
CID 22660698
5-[4-(2-phenylethynyl)phenyl]-1H-pyrazole
CID 2822641
1-methyl-5-(1H-pyrazol-5-yl)triazole
CID 173358547

Frequently Asked Questions

What is the IUPAC name of 5-(1H-pyrazol-5-yl)triazine?
The IUPAC name of 5-(1H-pyrazol-5-yl)triazine (CID 173069530) is 5-(1H-pyrazol-5-yl)triazine.
What is the SMILES notation for 5-(1H-pyrazol-5-yl)triazine?
The canonical SMILES for 5-(1H-pyrazol-5-yl)triazine is c1cc(-c2cnnnc2)[nH]n1.
What is the InChIKey of 5-(1H-pyrazol-5-yl)triazine?
The InChIKey is CWUUCXVMTJIUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5/c1-2-7-10-6(1)5-3-8-11-9-4-5/h1-4H,(H,7,10).
What are the key properties of 5-(1H-pyrazol-5-yl)triazine?
5-(1H-pyrazol-5-yl)triazine has a molecular weight of 147.14 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-pyrazol-5-yl)triazine is sourced from PubChem (CID 173069530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).