1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine

C17H17N7 — CID 24905148

IUPAC1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESNc1ncnc2c1c(-c1ccn3ccnc3c1)nn2C1CCCC1
InChIInChI=1S/C17H17N7/c18-16-14-15(11-5-7-23-8-6-19-13(23)9-11)22-24(12-3-1-2-4-12)17(14)21-10-20-16/h5-10,12H,1-4H2,(H2,18,20,21)
InChIKeyDTUMIKLOEHJGJT-UHFFFAOYSA-N
MW319.37 g/mol
LogP2.84
Rot. Bonds2

About 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine

1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 24905148) has the molecular formula C17H17N7 and a molecular weight of 319.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID24905148
Molecular FormulaC17H17N7
Molecular Weight319.37 g/mol
Exact Mass319.15
IUPAC Name1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESNc1ncnc2c1c(-c1ccn3ccnc3c1)nn2C1CCCC1
InChIInChI=1S/C17H17N7/c18-16-14-15(11-5-7-23-8-6-19-13(23)9-11)22-24(12-3-1-2-4-12)17(14)21-10-20-16/h5-10,12H,1-4H2,(H2,18,20,21)
InChIKeyDTUMIKLOEHJGJT-UHFFFAOYSA-N
XLogP2.84
TPSA86.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine (CID 24905148) is 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine is Nc1ncnc2c1c(-c1ccn3ccnc3c1)nn2C1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is DTUMIKLOEHJGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7/c18-16-14-15(11-5-7-23-8-6-19-13(23)9-11)22-24(12-3-1-2-4-12)17(14)21-10-20-16/h5-10,12H,1-4H2,(H2,18,20,21).
What are the key properties of 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine?
1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 319.37 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-imidazo[1,2-a]pyridin-7-ylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 24905148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).