6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid

C11H13N3O3 — CID 105495909

IUPAC6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid
SMILESCOc1nc2c(c(C)nn2C)c(C)c1C(=O)O
InChIInChI=1S/C11H13N3O3/c1-5-7-6(2)13-14(3)9(7)12-10(17-4)8(5)11(15)16/h1-4H3,(H,15,16)
InChIKeyUCJSOARJXAPNPW-UHFFFAOYSA-N
MW235.24 g/mol
LogP1.29
Rot. Bonds2

About 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid

6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid (PubChem CID 105495909) has the molecular formula C11H13N3O3 and a molecular weight of 235.24 g/mol. Its IUPAC name is 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid
PubChem CID105495909
Molecular FormulaC11H13N3O3
Molecular Weight235.24 g/mol
Exact Mass235.10
IUPAC Name6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid
SMILESCOc1nc2c(c(C)nn2C)c(C)c1C(=O)O
InChIInChI=1S/C11H13N3O3/c1-5-7-6(2)13-14(3)9(7)12-10(17-4)8(5)11(15)16/h1-4H3,(H,15,16)
InChIKeyUCJSOARJXAPNPW-UHFFFAOYSA-N
XLogP1.29
TPSA77.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,4-trimethylpyrazolo[5,4-b]pyridine-6-carboxylic acid
CID 84673110
6-methoxy-2,4-dimethyl-1,3-dihydropyrrolo[3,4-c]pyridine-7-carboxylic acid
CID 96606623
5-(4-methoxyphenyl)-1,3-dimethylpyrazole-4-carboxylic acid
CID 58962984
1-[3-(3-methoxy-1,4,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)propanoyl]-6-methylpiperidine-3-carboxylic acid
CID 122113261
3-[3-(3-methoxy-1,4,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)propanoylamino]propanoic acid
CID 119351297
1-(1,3-dimethylpyrazolo[5,4-c]isoquinolin-5-yl)oxypropan-2-one
CID 23332766
3-(3-methoxy-1,4,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)-N-phenylpropanamide
CID 38017763
3-(3-methoxy-1,4,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)-1-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]propan-1-one
CID 112820934
1,3-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 83907341
6-chloro-4-methoxy-1,3-dimethylpyrazolo[5,4-b]pyridine
CID 175964551
N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-3-(3-methoxy-1,4,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)propanamide
CID 55723342
6-methoxy-4-methylpyridine-2,5-dicarboxylic acid
CID 91509956

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The IUPAC name of 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid (CID 105495909) is 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid.
What is the SMILES notation for 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The canonical SMILES for 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid is COc1nc2c(c(C)nn2C)c(C)c1C(=O)O.
What is the InChIKey of 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The InChIKey is UCJSOARJXAPNPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3/c1-5-7-6(2)13-14(3)9(7)12-10(17-4)8(5)11(15)16/h1-4H3,(H,15,16).
What are the key properties of 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid has a molecular weight of 235.24 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,3,4-trimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid is sourced from PubChem (CID 105495909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).