5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine

C17H13N5 — CID 122478619

IUPAC5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
SMILESCc1cccc(-c2ncccc2-c2ccn3nccc3n2)n1
InChIInChI=1S/C17H13N5/c1-12-4-2-6-15(20-12)17-13(5-3-9-18-17)14-8-11-22-16(21-14)7-10-19-22/h2-11H,1H3
InChIKeyYVGRBVRWQJAYOX-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.16
Rot. Bonds2

About 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine

5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine (PubChem CID 122478619) has the molecular formula C17H13N5 and a molecular weight of 287.33 g/mol. Its IUPAC name is 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
PubChem CID122478619
Molecular FormulaC17H13N5
Molecular Weight287.33 g/mol
Exact Mass287.12
IUPAC Name5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
SMILESCc1cccc(-c2ncccc2-c2ccn3nccc3n2)n1
InChIInChI=1S/C17H13N5/c1-12-4-2-6-15(20-12)17-13(5-3-9-18-17)14-8-11-22-16(21-14)7-10-19-22/h2-11H,1H3
InChIKeyYVGRBVRWQJAYOX-UHFFFAOYSA-N
XLogP3.16
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine (CID 122478619) is 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine is Cc1cccc(-c2ncccc2-c2ccn3nccc3n2)n1.
What is the InChIKey of 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is YVGRBVRWQJAYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5/c1-12-4-2-6-15(20-12)17-13(5-3-9-18-17)14-8-11-22-16(21-14)7-10-19-22/h2-11H,1H3.
What are the key properties of 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine?
5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 287.33 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 122478619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).