pyrazolo[1,5-a][1,3,5]triazine;hydrochloride

C5H5ClN4 — CID 172732644

IUPACpyrazolo[1,5-a][1,3,5]triazine;hydrochloride
SMILESCl.c1ncn2nccc2n1
InChIInChI=1S/C5H4N4.ClH/c1-2-8-9-4-6-3-7-5(1)9;/h1-4H;1H
InChIKeyHZTAUCOHOUODDB-UHFFFAOYSA-N
MW156.58 g/mol
LogP0.55
Rot. Bonds

About pyrazolo[1,5-a][1,3,5]triazine;hydrochloride

pyrazolo[1,5-a][1,3,5]triazine;hydrochloride (PubChem CID 172732644) has the molecular formula C5H5ClN4 and a molecular weight of 156.58 g/mol. Its IUPAC name is pyrazolo[1,5-a][1,3,5]triazine;hydrochloride.

Molecular Properties

Compound Namepyrazolo[1,5-a][1,3,5]triazine;hydrochloride
PubChem CID172732644
Molecular FormulaC5H5ClN4
Molecular Weight156.58 g/mol
Exact Mass156.02
IUPAC Namepyrazolo[1,5-a][1,3,5]triazine;hydrochloride
SMILESCl.c1ncn2nccc2n1
InChIInChI=1S/C5H4N4.ClH/c1-2-8-9-4-6-3-7-5(1)9;/h1-4H;1H
InChIKeyHZTAUCOHOUODDB-UHFFFAOYSA-N
XLogP0.55
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.58
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromopyrazolo[1,5-a]pyrimidine
CID 22236701
6-methylpyrazolo[1,5-a]pyrimidine
CID 12773553
pyrazolo[1,5-a]pyrimidine;sulfuric acid
CID 172707658
2-butylpyrazolo[1,5-a][1,3,5]triazine
CID 22115514
4-methylimidazo[1,5-b]pyridazine
CID 57010860
4-ethylpyrazolo[1,5-a][1,3,5]triazine
CID 154468252
6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine
CID 59277764
3-pyrazolo[1,5-a]pyrimidin-6-ylbutan-1-amine
CID 84771579
2-([1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-1,3-oxazole
CID 175691572
1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile
CID 84774894
2-([1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-1,3-oxazole
CID 175691571
pyrazolo[1,5-a]pyrimidin-5-olate
CID 51386982

Frequently Asked Questions

What is the IUPAC name of pyrazolo[1,5-a][1,3,5]triazine;hydrochloride?
The IUPAC name of pyrazolo[1,5-a][1,3,5]triazine;hydrochloride (CID 172732644) is pyrazolo[1,5-a][1,3,5]triazine;hydrochloride.
What is the SMILES notation for pyrazolo[1,5-a][1,3,5]triazine;hydrochloride?
The canonical SMILES for pyrazolo[1,5-a][1,3,5]triazine;hydrochloride is Cl.c1ncn2nccc2n1.
What is the InChIKey of pyrazolo[1,5-a][1,3,5]triazine;hydrochloride?
The InChIKey is HZTAUCOHOUODDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N4.ClH/c1-2-8-9-4-6-3-7-5(1)9;/h1-4H;1H.
What are the key properties of pyrazolo[1,5-a][1,3,5]triazine;hydrochloride?
pyrazolo[1,5-a][1,3,5]triazine;hydrochloride has a molecular weight of 156.58 g/mol, XLogP of 0.55, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazolo[1,5-a][1,3,5]triazine;hydrochloride is sourced from PubChem (CID 172732644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).