3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine

C19H13N7 — CID 11508347

IUPAC3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cc(-c3cnc4ccccc4n3)cnc2c1-c1ccccn1
InChIInChI=1S/C19H13N7/c20-18-17(15-7-3-4-8-21-15)19-23-9-12(11-26(19)25-18)16-10-22-13-5-1-2-6-14(13)24-16/h1-11H,(H2,20,25)
InChIKeyASODUQNZKKRBIQ-UHFFFAOYSA-N
MW339.36 g/mol
LogP2.98
Rot. Bonds2

About 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine

3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine (PubChem CID 11508347) has the molecular formula C19H13N7 and a molecular weight of 339.36 g/mol. Its IUPAC name is 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine
PubChem CID11508347
Molecular FormulaC19H13N7
Molecular Weight339.36 g/mol
Exact Mass339.12
IUPAC Name3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cc(-c3cnc4ccccc4n3)cnc2c1-c1ccccn1
InChIInChI=1S/C19H13N7/c20-18-17(15-7-3-4-8-21-15)19-23-9-12(11-26(19)25-18)16-10-22-13-5-1-2-6-14(13)24-16/h1-11H,(H2,20,25)
InChIKeyASODUQNZKKRBIQ-UHFFFAOYSA-N
XLogP2.98
TPSA94.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine (CID 11508347) is 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine is Nc1nn2cc(-c3cnc4ccccc4n3)cnc2c1-c1ccccn1.
What is the InChIKey of 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is ASODUQNZKKRBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N7/c20-18-17(15-7-3-4-8-21-15)19-23-9-12(11-26(19)25-18)16-10-22-13-5-1-2-6-14(13)24-16/h1-11H,(H2,20,25).
What are the key properties of 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine?
3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 339.36 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-6-quinoxalin-2-ylpyrazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 11508347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).