2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine

C17H14N8O — CID 134198101

IUPAC2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine
SMILESCc1cc(Cn2cc3ncc(Nc4n[nH]c5cccnc45)cc3n2)no1
InChIInChI=1S/C17H14N8O/c1-10-5-12(24-26-10)8-25-9-15-14(23-25)6-11(7-19-15)20-17-16-13(21-22-17)3-2-4-18-16/h2-7,9H,8H2,1H3,(H2,20,21,22)
InChIKeyJSAWRZPPRWGUHX-UHFFFAOYSA-N
MW346.35 g/mol
LogP2.79
Rot. Bonds4

About 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine

2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine (PubChem CID 134198101) has the molecular formula C17H14N8O and a molecular weight of 346.35 g/mol. Its IUPAC name is 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine.

Molecular Properties

Compound Name2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine
PubChem CID134198101
Molecular FormulaC17H14N8O
Molecular Weight346.35 g/mol
Exact Mass346.13
IUPAC Name2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine
SMILESCc1cc(Cn2cc3ncc(Nc4n[nH]c5cccnc45)cc3n2)no1
InChIInChI=1S/C17H14N8O/c1-10-5-12(24-26-10)8-25-9-15-14(23-25)6-11(7-19-15)20-17-16-13(21-22-17)3-2-4-18-16/h2-7,9H,8H2,1H3,(H2,20,21,22)
InChIKeyJSAWRZPPRWGUHX-UHFFFAOYSA-N
XLogP2.79
TPSA110.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.35
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine?
The IUPAC name of 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine (CID 134198101) is 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine.
What is the SMILES notation for 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine?
The canonical SMILES for 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine is Cc1cc(Cn2cc3ncc(Nc4n[nH]c5cccnc45)cc3n2)no1.
What is the InChIKey of 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine?
The InChIKey is JSAWRZPPRWGUHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N8O/c1-10-5-12(24-26-10)8-25-9-15-14(23-25)6-11(7-19-15)20-17-16-13(21-22-17)3-2-4-18-16/h2-7,9H,8H2,1H3,(H2,20,21,22).
What are the key properties of 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine?
2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine has a molecular weight of 346.35 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-1,2-oxazol-3-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)pyrazolo[4,3-b]pyridin-6-amine is sourced from PubChem (CID 134198101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).