5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine

C11H9N5 — CID 134337598

IUPAC5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine
SMILESCc1ncc2[nH]nc(-c3cccnc3)c2n1
InChIInChI=1S/C11H9N5/c1-7-13-6-9-11(14-7)10(16-15-9)8-3-2-4-12-5-8/h2-6H,1H3,(H,15,16)
InChIKeyDCOWNDRJUSNUHA-UHFFFAOYSA-N
MW211.23 g/mol
LogP1.72
Rot. Bonds1

About 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine

5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine (PubChem CID 134337598) has the molecular formula C11H9N5 and a molecular weight of 211.23 g/mol. Its IUPAC name is 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine.

Molecular Properties

Compound Name5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine
PubChem CID134337598
Molecular FormulaC11H9N5
Molecular Weight211.23 g/mol
Exact Mass211.09
IUPAC Name5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine
SMILESCc1ncc2[nH]nc(-c3cccnc3)c2n1
InChIInChI=1S/C11H9N5/c1-7-13-6-9-11(14-7)10(16-15-9)8-3-2-4-12-5-8/h2-6H,1H3,(H,15,16)
InChIKeyDCOWNDRJUSNUHA-UHFFFAOYSA-N
XLogP1.72
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-diphenyl-1H-pyrazolo[4,3-d]pyrimidine;ethane
CID 159273056
3-[4-(3-methylphenyl)-1H-imidazo[4,5-c]pyridin-2-yl]-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137308906
4-pyridin-3-yl-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
CID 137019318
3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137038916
3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane
CID 160775016
5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
CID 86676680
5-(5-methyl-3-pyridinyl)-3-(4-pyridin-3-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 145254746
3-[4-(5-methylthiophen-2-yl)-1H-benzimidazol-2-yl]-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
CID 136942394
5-pyridin-3-yl-3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137109752
3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine
CID 67256316
2-[5-(1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-4-pyridin-3-yl-1H-imidazo[4,5-c]pyridine
CID 137038844
5-pyridin-3-yl-3-(2H-pyrrol-5-yl)-1H-pyrazolo[3,4-c]pyridine
CID 161100284

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine?
The IUPAC name of 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine (CID 134337598) is 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine.
What is the SMILES notation for 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine?
The canonical SMILES for 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine is Cc1ncc2[nH]nc(-c3cccnc3)c2n1.
What is the InChIKey of 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine?
The InChIKey is DCOWNDRJUSNUHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5/c1-7-13-6-9-11(14-7)10(16-15-9)8-3-2-4-12-5-8/h2-6H,1H3,(H,15,16).
What are the key properties of 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine?
5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine has a molecular weight of 211.23 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine is sourced from PubChem (CID 134337598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).