5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine

C13H11FN4 — CID 171349654

IUPAC5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine
SMILESCn1cc2cc(-c3ccccc3F)c(N)nc2n1
InChIInChI=1S/C13H11FN4/c1-18-7-8-6-10(12(15)16-13(8)17-18)9-4-2-3-5-11(9)14/h2-7H,1H3,(H2,15,16,17)
InChIKeyIYTGYWQPHUCWPU-UHFFFAOYSA-N
MW242.26 g/mol
LogP2.36
Rot. Bonds1

About 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine

5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine (PubChem CID 171349654) has the molecular formula C13H11FN4 and a molecular weight of 242.26 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine.

Molecular Properties

Compound Name5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine
PubChem CID171349654
Molecular FormulaC13H11FN4
Molecular Weight242.26 g/mol
Exact Mass242.10
IUPAC Name5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine
SMILESCn1cc2cc(-c3ccccc3F)c(N)nc2n1
InChIInChI=1S/C13H11FN4/c1-18-7-8-6-10(12(15)16-13(8)17-18)9-4-2-3-5-11(9)14/h2-7H,1H3,(H2,15,16,17)
InChIKeyIYTGYWQPHUCWPU-UHFFFAOYSA-N
XLogP2.36
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine?
The IUPAC name of 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine (CID 171349654) is 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine.
What is the SMILES notation for 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine?
The canonical SMILES for 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine is Cn1cc2cc(-c3ccccc3F)c(N)nc2n1.
What is the InChIKey of 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine?
The InChIKey is IYTGYWQPHUCWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4/c1-18-7-8-6-10(12(15)16-13(8)17-18)9-4-2-3-5-11(9)14/h2-7H,1H3,(H2,15,16,17).
What are the key properties of 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine?
5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine has a molecular weight of 242.26 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-2-methylpyrazolo[3,4-b]pyridin-6-amine is sourced from PubChem (CID 171349654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).