1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine

C10H13N5 — CID 97181303

IUPAC1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine
SMILESNc1nn(C2CCCC2)c2nccnc12
InChIInChI=1S/C10H13N5/c11-9-8-10(13-6-5-12-8)15(14-9)7-3-1-2-4-7/h5-7H,1-4H2,(H2,11,14)
InChIKeyGXGVIYSGYJABBS-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.52
Rot. Bonds1

About 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine

1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine (PubChem CID 97181303) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine.

Molecular Properties

Compound Name1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine
PubChem CID97181303
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine
SMILESNc1nn(C2CCCC2)c2nccnc12
InChIInChI=1S/C10H13N5/c11-9-8-10(13-6-5-12-8)15(14-9)7-3-1-2-4-7/h5-7H,1-4H2,(H2,11,14)
InChIKeyGXGVIYSGYJABBS-UHFFFAOYSA-N
XLogP1.52
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine?
The IUPAC name of 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine (CID 97181303) is 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine.
What is the SMILES notation for 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine?
The canonical SMILES for 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine is Nc1nn(C2CCCC2)c2nccnc12.
What is the InChIKey of 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine?
The InChIKey is GXGVIYSGYJABBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c11-9-8-10(13-6-5-12-8)15(14-9)7-3-1-2-4-7/h5-7H,1-4H2,(H2,11,14).
What are the key properties of 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine?
1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine has a molecular weight of 203.25 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylpyrazolo[3,4-b]pyrazin-3-amine is sourced from PubChem (CID 97181303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).