3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine

C11H16N4 — CID 84672589

IUPAC3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine
SMILESCc1cc(N)c2c(C(C)(C)C)[nH]nc2n1
InChIInChI=1S/C11H16N4/c1-6-5-7(12)8-9(11(2,3)4)14-15-10(8)13-6/h5H,1-4H3,(H3,12,13,14,15)
InChIKeyAGMVFWOGPHVFGP-UHFFFAOYSA-N
MW204.28 g/mol
LogP2.15
Rot. Bonds

About 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine

3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine (PubChem CID 84672589) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine.

Molecular Properties

Compound Name3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine
PubChem CID84672589
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine
SMILESCc1cc(N)c2c(C(C)(C)C)[nH]nc2n1
InChIInChI=1S/C11H16N4/c1-6-5-7(12)8-9(11(2,3)4)14-15-10(8)13-6/h5H,1-4H3,(H3,12,13,14,15)
InChIKeyAGMVFWOGPHVFGP-UHFFFAOYSA-N
XLogP2.15
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine?
The IUPAC name of 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine (CID 84672589) is 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine.
What is the SMILES notation for 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine?
The canonical SMILES for 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine is Cc1cc(N)c2c(C(C)(C)C)[nH]nc2n1.
What is the InChIKey of 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine?
The InChIKey is AGMVFWOGPHVFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-6-5-7(12)8-9(11(2,3)4)14-15-10(8)13-6/h5H,1-4H3,(H3,12,13,14,15).
What are the key properties of 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine?
3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine has a molecular weight of 204.28 g/mol, XLogP of 2.15, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6-methyl-2H-pyrazolo[3,4-b]pyridin-4-amine is sourced from PubChem (CID 84672589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).