1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide

C13H14N6O — CID 110472934

IUPAC1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide
SMILESCc1nn(C)c(C)c1C(=O)Nc1[nH]nc2ncccc12
InChIInChI=1S/C13H14N6O/c1-7-10(8(2)19(3)18-7)13(20)15-12-9-5-4-6-14-11(9)16-17-12/h4-6H,1-3H3,(H2,14,15,16,17,20)
InChIKeyOSOZTRWJZCGVQR-UHFFFAOYSA-N
MW270.30 g/mol
LogP1.56
Rot. Bonds2

About 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide

1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide (PubChem CID 110472934) has the molecular formula C13H14N6O and a molecular weight of 270.30 g/mol. Its IUPAC name is 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide
PubChem CID110472934
Molecular FormulaC13H14N6O
Molecular Weight270.30 g/mol
Exact Mass270.12
IUPAC Name1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide
SMILESCc1nn(C)c(C)c1C(=O)Nc1[nH]nc2ncccc12
InChIInChI=1S/C13H14N6O/c1-7-10(8(2)19(3)18-7)13(20)15-12-9-5-4-6-14-11(9)16-17-12/h4-6H,1-3H3,(H2,14,15,16,17,20)
InChIKeyOSOZTRWJZCGVQR-UHFFFAOYSA-N
XLogP1.56
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110472978
4-bromo-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110868084
3,5-dimethoxy-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110866777
3-hydroxy-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide
CID 110472353
1,3,5-trimethyl-N-phenylpyrazole-4-carboxamide
CID 19281566
2,4,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)pyrazole-3-carboxamide
CID 138381067
2-cyano-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)acetamide
CID 110470080
2-(4-hydroxyphenyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)acetamide
CID 110472847
N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 19281528
N-(2,3-dimethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 17423389
N-[3-(butanoylamino)phenyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 87026220
1,3,5-trimethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]pyrazole-4-carboxamide
CID 134053136

Frequently Asked Questions

What is the IUPAC name of 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide?
The IUPAC name of 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide (CID 110472934) is 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide is Cc1nn(C)c(C)c1C(=O)Nc1[nH]nc2ncccc12.
What is the InChIKey of 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide?
The InChIKey is OSOZTRWJZCGVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O/c1-7-10(8(2)19(3)18-7)13(20)15-12-9-5-4-6-14-11(9)16-17-12/h4-6H,1-3H3,(H2,14,15,16,17,20).
What are the key properties of 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide?
1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide has a molecular weight of 270.30 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trimethyl-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 110472934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).