2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol

C12H14N6O — CID 103128980

IUPAC2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
SMILESCCn1ncnc1CC(O)c1cnn2ccncc12
InChIInChI=1S/C12H14N6O/c1-2-17-12(14-8-16-17)5-11(19)9-6-15-18-4-3-13-7-10(9)18/h3-4,6-8,11,19H,2,5H2,1H3
InChIKeyFTHRZLKIRXBJHP-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.62
Rot. Bonds4

About 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol

2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol (PubChem CID 103128980) has the molecular formula C12H14N6O and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol.

Molecular Properties

Compound Name2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
PubChem CID103128980
Molecular FormulaC12H14N6O
Molecular Weight258.28 g/mol
Exact Mass258.12
IUPAC Name2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
SMILESCCn1ncnc1CC(O)c1cnn2ccncc12
InChIInChI=1S/C12H14N6O/c1-2-17-12(14-8-16-17)5-11(19)9-6-15-18-4-3-13-7-10(9)18/h3-4,6-8,11,19H,2,5H2,1H3
InChIKeyFTHRZLKIRXBJHP-UHFFFAOYSA-N
XLogP0.62
TPSA81.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127579
2-(2,6-dimethylphenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129126
2-(2,6-difluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129309
2-(2-bromophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103128491
2-(2-ethyl-1,2,4-triazol-3-yl)-1-(1-propan-2-ylpyrazol-4-yl)ethanol
CID 114075656
1-(5-chloro-1-methylimidazol-2-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethanol
CID 114239421
2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinoxalin-5-ylethanol
CID 105109150
2-cyclobutyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103128870
2-(4-tert-butyl-1,3-thiazol-2-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129067
2-(3-bromo-5-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129064
2-(1-ethylimidazol-2-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanol
CID 103129027
2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105109180

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol?
The IUPAC name of 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol (CID 103128980) is 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol.
What is the SMILES notation for 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol?
The canonical SMILES for 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol is CCn1ncnc1CC(O)c1cnn2ccncc12.
What is the InChIKey of 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol?
The InChIKey is FTHRZLKIRXBJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O/c1-2-17-12(14-8-16-17)5-11(19)9-6-15-18-4-3-13-7-10(9)18/h3-4,6-8,11,19H,2,5H2,1H3.
What are the key properties of 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol?
2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol has a molecular weight of 258.28 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol is sourced from PubChem (CID 103128980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).