3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine

C13H10N6 — CID 170553720

IUPAC3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine
SMILESCc1[nH]nc2cc(-c3cnn4cccnc34)ncc12
InChIInChI=1S/C13H10N6/c1-8-9-6-15-11(5-12(9)18-17-8)10-7-16-19-4-2-3-14-13(10)19/h2-7H,1H3,(H,17,18)
InChIKeyHHLQOWLDKNOSIG-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.98
Rot. Bonds1

About 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine

3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine (PubChem CID 170553720) has the molecular formula C13H10N6 and a molecular weight of 250.27 g/mol. Its IUPAC name is 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine
PubChem CID170553720
Molecular FormulaC13H10N6
Molecular Weight250.27 g/mol
Exact Mass250.10
IUPAC Name3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine
SMILESCc1[nH]nc2cc(-c3cnn4cccnc34)ncc12
InChIInChI=1S/C13H10N6/c1-8-9-6-15-11(5-12(9)18-17-8)10-7-16-19-4-2-3-14-13(10)19/h2-7H,1H3,(H,17,18)
InChIKeyHHLQOWLDKNOSIG-UHFFFAOYSA-N
XLogP1.98
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine (CID 170553720) is 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine is Cc1[nH]nc2cc(-c3cnn4cccnc34)ncc12.
What is the InChIKey of 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is HHLQOWLDKNOSIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6/c1-8-9-6-15-11(5-12(9)18-17-8)10-7-16-19-4-2-3-14-13(10)19/h2-7H,1H3,(H,17,18).
What are the key properties of 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine?
3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 250.27 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-pyrazolo[1,5-a]pyrimidin-3-yl-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 170553720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).