3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide

C13H11N5O — CID 126509405

IUPAC3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide
SMILESCc1c(C(N)=O)ccnc1-n1ncc2cccnc21
InChIInChI=1S/C13H11N5O/c1-8-10(11(14)19)4-6-16-12(8)18-13-9(7-17-18)3-2-5-15-13/h2-7H,1H3,(H2,14,19)
InChIKeySVALDWFXGKRZMU-UHFFFAOYSA-N
MW253.27 g/mol
LogP1.22
Rot. Bonds2

About 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide

3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide (PubChem CID 126509405) has the molecular formula C13H11N5O and a molecular weight of 253.27 g/mol. Its IUPAC name is 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide
PubChem CID126509405
Molecular FormulaC13H11N5O
Molecular Weight253.27 g/mol
Exact Mass253.10
IUPAC Name3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide
SMILESCc1c(C(N)=O)ccnc1-n1ncc2cccnc21
InChIInChI=1S/C13H11N5O/c1-8-10(11(14)19)4-6-16-12(8)18-13-9(7-17-18)3-2-5-15-13/h2-7H,1H3,(H2,14,19)
InChIKeySVALDWFXGKRZMU-UHFFFAOYSA-N
XLogP1.22
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide?
The IUPAC name of 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide (CID 126509405) is 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide.
What is the SMILES notation for 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide?
The canonical SMILES for 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide is Cc1c(C(N)=O)ccnc1-n1ncc2cccnc21.
What is the InChIKey of 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide?
The InChIKey is SVALDWFXGKRZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O/c1-8-10(11(14)19)4-6-16-12(8)18-13-9(7-17-18)3-2-5-15-13/h2-7H,1H3,(H2,14,19).
What are the key properties of 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide?
3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide has a molecular weight of 253.27 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-pyrazolo[5,4-b]pyridin-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 126509405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).