6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine

C14H10N6O — CID 11952670

IUPAC6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(-c3ccco3)c(-c3ccncn3)cc12
InChIInChI=1S/C14H10N6O/c15-13-9-6-8(10-3-4-16-7-17-10)12(11-2-1-5-21-11)18-14(9)20-19-13/h1-7H,(H3,15,18,19,20)
InChIKeyCUIYZPCLAYEKMZ-UHFFFAOYSA-N
MW278.28 g/mol
LogP2.26
Rot. Bonds2

About 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine

6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 11952670) has the molecular formula C14H10N6O and a molecular weight of 278.28 g/mol. Its IUPAC name is 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

Compound Name6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
PubChem CID11952670
Molecular FormulaC14H10N6O
Molecular Weight278.28 g/mol
Exact Mass278.09
IUPAC Name6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(-c3ccco3)c(-c3ccncn3)cc12
InChIInChI=1S/C14H10N6O/c15-13-9-6-8(10-3-4-16-7-17-10)12(11-2-1-5-21-11)18-14(9)20-19-13/h1-7H,(H3,15,18,19,20)
InChIKeyCUIYZPCLAYEKMZ-UHFFFAOYSA-N
XLogP2.26
TPSA106.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 11952670) is 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine is Nc1[nH]nc2nc(-c3ccco3)c(-c3ccncn3)cc12.
What is the InChIKey of 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is CUIYZPCLAYEKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O/c15-13-9-6-8(10-3-4-16-7-17-10)12(11-2-1-5-21-11)18-14(9)20-19-13/h1-7H,(H3,15,18,19,20).
What are the key properties of 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine?
6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 278.28 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-5-pyrimidin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 11952670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).