2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

C12H14N6 — CID 103127963

IUPAC2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
SMILESCn1ccc(CC(N)c2cnn3ccncc23)n1
InChIInChI=1S/C12H14N6/c1-17-4-2-9(16-17)6-11(13)10-7-15-18-5-3-14-8-12(10)18/h2-5,7-8,11H,6,13H2,1H3
InChIKeyNEMQJEKDBNHGLY-UHFFFAOYSA-N
MW242.29 g/mol
LogP0.71
Rot. Bonds3

About 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine (PubChem CID 103127963) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine.

Molecular Properties

Compound Name2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
PubChem CID103127963
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC Name2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
SMILESCn1ccc(CC(N)c2cnn3ccncc23)n1
InChIInChI=1S/C12H14N6/c1-17-4-2-9(16-17)6-11(13)10-7-15-18-5-3-14-8-12(10)18/h2-5,7-8,11H,6,13H2,1H3
InChIKeyNEMQJEKDBNHGLY-UHFFFAOYSA-N
XLogP0.71
TPSA74.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-pyrazolo[1,5-a]pyrazin-3-yl-2-pyridin-2-ylethanamine
CID 103127478
1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103125780
2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127505
2-(3,5-difluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103128392
3-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 103126804
3,5-dimethyl-1-pyrazolo[1,5-a]pyrazin-3-ylhexan-1-amine
CID 114201709
2-(2-ethyl-1,2,4-triazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127579
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103127934
2-(2-chloro-6-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126337
2-(4-bromo-2-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126754
2-(1-methylpyrazol-3-yl)-1-pyrimidin-5-ylethanamine
CID 102923732
2-(5-bromo-2-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126629

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The IUPAC name of 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine (CID 103127963) is 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine.
What is the SMILES notation for 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The canonical SMILES for 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine is Cn1ccc(CC(N)c2cnn3ccncc23)n1.
What is the InChIKey of 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
The InChIKey is NEMQJEKDBNHGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c1-17-4-2-9(16-17)6-11(13)10-7-15-18-5-3-14-8-12(10)18/h2-5,7-8,11H,6,13H2,1H3.
What are the key properties of 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine?
2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine has a molecular weight of 242.29 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine is sourced from PubChem (CID 103127963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).