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

C22H18N2O4 — CID 71284653

IUPAC5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(ccn3-c3ccccc3)c2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C22H18N2O4/c1-2-16-19(23-21(26)18(20(16)25)22(27)28)14-8-9-17-13(12-14)10-11-24(17)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,27,28)(H2,23,25,26)
InChIKeyQEQPWJGMKDRPTF-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.95
Rot. Bonds4

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

5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid (PubChem CID 71284653) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid
PubChem CID71284653
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC Name5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2ccc3c(ccn3-c3ccccc3)c2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C22H18N2O4/c1-2-16-19(23-21(26)18(20(16)25)22(27)28)14-8-9-17-13(12-14)10-11-24(17)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,27,28)(H2,23,25,26)
InChIKeyQEQPWJGMKDRPTF-UHFFFAOYSA-N
XLogP3.95
TPSA95.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid?
The IUPAC name of 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid (CID 71284653) is 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid is CCc1c(-c2ccc3c(ccn3-c3ccccc3)c2)[nH]c(=O)c(C(=O)O)c1O.
What is the InChIKey of 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid?
The InChIKey is QEQPWJGMKDRPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c1-2-16-19(23-21(26)18(20(16)25)22(27)28)14-8-9-17-13(12-14)10-11-24(17)15-6-4-3-5-7-15/h3-12H,2H2,1H3,(H,27,28)(H2,23,25,26).
What are the key properties of 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid?
5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid has a molecular weight of 374.40 g/mol, XLogP of 3.95, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-hydroxy-2-oxo-6-(1-phenylindol-5-yl)-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 71284653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).