1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine

C11H12N6 — CID 136922716

IUPAC1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1[nH]ncc1-c1nn(C)c2ncc(N)cc12
InChIInChI=1S/C11H12N6/c1-6-9(5-14-15-6)10-8-3-7(12)4-13-11(8)17(2)16-10/h3-5H,12H2,1-2H3,(H,14,15)
InChIKeyXMKDUYJFLCHXJO-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.25
Rot. Bonds1

About 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine

1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine (PubChem CID 136922716) has the molecular formula C11H12N6 and a molecular weight of 228.26 g/mol. Its IUPAC name is 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine.

Molecular Properties

Compound Name1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine
PubChem CID136922716
Molecular FormulaC11H12N6
Molecular Weight228.26 g/mol
Exact Mass228.11
IUPAC Name1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1[nH]ncc1-c1nn(C)c2ncc(N)cc12
InChIInChI=1S/C11H12N6/c1-6-9(5-14-15-6)10-8-3-7(12)4-13-11(8)17(2)16-10/h3-5H,12H2,1-2H3,(H,14,15)
InChIKeyXMKDUYJFLCHXJO-UHFFFAOYSA-N
XLogP1.25
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine?
The IUPAC name of 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine (CID 136922716) is 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine.
What is the SMILES notation for 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine?
The canonical SMILES for 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine is Cc1[nH]ncc1-c1nn(C)c2ncc(N)cc12.
What is the InChIKey of 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine?
The InChIKey is XMKDUYJFLCHXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6/c1-6-9(5-14-15-6)10-8-3-7(12)4-13-11(8)17(2)16-10/h3-5H,12H2,1-2H3,(H,14,15).
What are the key properties of 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine?
1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine has a molecular weight of 228.26 g/mol, XLogP of 1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(5-methyl-1H-pyrazol-4-yl)pyrazolo[5,4-b]pyridin-5-amine is sourced from PubChem (CID 136922716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).