1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one

C9H11N3O — CID 136842584

IUPAC1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCC(C)n1ncc2ccc(=O)[nH]c21
InChIInChI=1S/C9H11N3O/c1-6(2)12-9-7(5-10-12)3-4-8(13)11-9/h3-6H,1-2H3,(H,11,13)
InChIKeyMUMPUBOTLRMDDE-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.31
Rot. Bonds1

About 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one

1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 136842584) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID136842584
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one
SMILESCC(C)n1ncc2ccc(=O)[nH]c21
InChIInChI=1S/C9H11N3O/c1-6(2)12-9-7(5-10-12)3-4-8(13)11-9/h3-6H,1-2H3,(H,11,13)
InChIKeyMUMPUBOTLRMDDE-UHFFFAOYSA-N
XLogP1.31
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6-oxo-1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-5-yl)-N-propan-2-ylprop-2-enamide
CID 154770693
1-propan-2-yl-4H-triazolo[4,5-b]pyridin-5-one
CID 122696559
(Z)-N-(4-fluorophenyl)-3-(6-oxo-1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-5-yl)prop-2-enamide
CID 136696061
6-fluoro-2-propan-2-ylphthalazin-1-one
CID 125456255
4-hydroxy-6-oxo-1-propan-2-yl-7H-pyrazolo[5,4-b]pyridine-5-carboxylic acid
CID 136953131
1-propan-2-ylpyrazolo[5,4-c]pyridine
CID 122471541
1-propan-2-yl-5H-pyrazolo[4,5-c]pyridin-4-one
CID 137277698
5-(hydroxyamino)-2-propan-2-yl-1,2,4-triazin-3-one
CID 164541114
2,4-difluoro-5-[[(E)-3-(6-oxo-1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-5-yl)prop-2-enoyl]amino]benzamide
CID 167814920
6-(2-methylpropyl)-1-propan-2-ylindazole
CID 138583309
1-butan-2-yl-4-methyl-7H-pyrazolo[5,4-b]pyridin-6-one
CID 135600424
7-chloro-3-propan-2-ylpyrido[3,4-d]pyridazin-4-one
CID 167949901

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one (CID 136842584) is 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one is CC(C)n1ncc2ccc(=O)[nH]c21.
What is the InChIKey of 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is MUMPUBOTLRMDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-6(2)12-9-7(5-10-12)3-4-8(13)11-9/h3-6H,1-2H3,(H,11,13).
What are the key properties of 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one?
1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 177.21 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 136842584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).