1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid

C15H20N4O2 — CID 16794511

IUPAC1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid
SMILESCCN1CCC(n2ncc3c(C(=O)O)cc(C)nc32)CC1
InChIInChI=1S/C15H20N4O2/c1-3-18-6-4-11(5-7-18)19-14-13(9-16-19)12(15(20)21)8-10(2)17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21)
InChIKeyDPYKDMSIKHJIOA-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.09
Rot. Bonds3

About 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid

1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid (PubChem CID 16794511) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid
PubChem CID16794511
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid
SMILESCCN1CCC(n2ncc3c(C(=O)O)cc(C)nc32)CC1
InChIInChI=1S/C15H20N4O2/c1-3-18-6-4-11(5-7-18)19-14-13(9-16-19)12(15(20)21)8-10(2)17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21)
InChIKeyDPYKDMSIKHJIOA-UHFFFAOYSA-N
XLogP2.09
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid (CID 16794511) is 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid is CCN1CCC(n2ncc3c(C(=O)O)cc(C)nc32)CC1.
What is the InChIKey of 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid?
The InChIKey is DPYKDMSIKHJIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-3-18-6-4-11(5-7-18)19-14-13(9-16-19)12(15(20)21)8-10(2)17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21).
What are the key properties of 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid?
1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid has a molecular weight of 288.35 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-4-yl)-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 16794511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).