5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid

C16H15N3O4 — CID 71281741

IUPAC5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(cnn3C)c2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C16H15N3O4/c1-3-10-13(18-15(21)12(14(10)20)16(22)23)8-4-5-11-9(6-8)7-17-19(11)2/h4-7H,3H2,1-2H3,(H,22,23)(H2,18,20,21)
InChIKeyDNFJBAYVZAGTKN-UHFFFAOYSA-N
MW313.31 g/mol
LogP1.89
Rot. Bonds3

About 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid

5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 71281741) has the molecular formula C16H15N3O4 and a molecular weight of 313.31 g/mol. Its IUPAC name is 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID71281741
Molecular FormulaC16H15N3O4
Molecular Weight313.31 g/mol
Exact Mass313.11
IUPAC Name5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(cnn3C)c2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C16H15N3O4/c1-3-10-13(18-15(21)12(14(10)20)16(22)23)8-4-5-11-9(6-8)7-17-19(11)2/h4-7H,3H2,1-2H3,(H,22,23)(H2,18,20,21)
InChIKeyDNFJBAYVZAGTKN-UHFFFAOYSA-N
XLogP1.89
TPSA108.21 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid (CID 71281741) is 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid is CCc1c(-c2ccc3c(cnn3C)c2)[nH]c(=O)c(C(=O)O)c1O.
What is the InChIKey of 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is DNFJBAYVZAGTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4/c1-3-10-13(18-15(21)12(14(10)20)16(22)23)8-4-5-11-9(6-8)7-17-19(11)2/h4-7H,3H2,1-2H3,(H,22,23)(H2,18,20,21).
What are the key properties of 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid?
5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 313.31 g/mol, XLogP of 1.89, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-hydroxy-6-(1-methylindazol-5-yl)-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 71281741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).