1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid

C9H11N3O4 — CID 135376691

IUPAC1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
SMILESO=C1CN(C(=O)O)Cc2c1cnn2CCO
InChIInChI=1S/C9H11N3O4/c13-2-1-12-7-4-11(9(15)16)5-8(14)6(7)3-10-12/h3,13H,1-2,4-5H2,(H,15,16)
InChIKeyRYZCOJFLAFWWBQ-UHFFFAOYSA-N
MW225.20 g/mol
LogP-0.45
Rot. Bonds2

About 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid

1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid (PubChem CID 135376691) has the molecular formula C9H11N3O4 and a molecular weight of 225.20 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
PubChem CID135376691
Molecular FormulaC9H11N3O4
Molecular Weight225.20 g/mol
Exact Mass225.07
IUPAC Name1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
SMILESO=C1CN(C(=O)O)Cc2c1cnn2CCO
InChIInChI=1S/C9H11N3O4/c13-2-1-12-7-4-11(9(15)16)5-8(14)6(7)3-10-12/h3,13H,1-2,4-5H2,(H,15,16)
InChIKeyRYZCOJFLAFWWBQ-UHFFFAOYSA-N
XLogP-0.45
TPSA95.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.20
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The IUPAC name of 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid (CID 135376691) is 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid.
What is the SMILES notation for 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The canonical SMILES for 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid is O=C1CN(C(=O)O)Cc2c1cnn2CCO.
What is the InChIKey of 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The InChIKey is RYZCOJFLAFWWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O4/c13-2-1-12-7-4-11(9(15)16)5-8(14)6(7)3-10-12/h3,13H,1-2,4-5H2,(H,15,16).
What are the key properties of 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid has a molecular weight of 225.20 g/mol, XLogP of -0.45, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid is sourced from PubChem (CID 135376691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).