3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one

C15H12N2O2 — CID 137027848

IUPAC3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one
SMILESCn1c(=O)c(O)c(-c2ccncc2)c2ccccc21
InChIInChI=1S/C15H12N2O2/c1-17-12-5-3-2-4-11(12)13(14(18)15(17)19)10-6-8-16-9-7-10/h2-9,18H,1H3
InChIKeyUKPPJYNKBJEPRD-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.31
Rot. Bonds1

About 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one

3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one (PubChem CID 137027848) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one.

Molecular Properties

Compound Name3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one
PubChem CID137027848
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one
SMILESCn1c(=O)c(O)c(-c2ccncc2)c2ccccc21
InChIInChI=1S/C15H12N2O2/c1-17-12-5-3-2-4-11(12)13(14(18)15(17)19)10-6-8-16-9-7-10/h2-9,18H,1H3
InChIKeyUKPPJYNKBJEPRD-UHFFFAOYSA-N
XLogP2.31
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one?
The IUPAC name of 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one (CID 137027848) is 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one.
What is the SMILES notation for 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one?
The canonical SMILES for 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one is Cn1c(=O)c(O)c(-c2ccncc2)c2ccccc21.
What is the InChIKey of 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one?
The InChIKey is UKPPJYNKBJEPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-17-12-5-3-2-4-11(12)13(14(18)15(17)19)10-6-8-16-9-7-10/h2-9,18H,1H3.
What are the key properties of 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one?
3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one has a molecular weight of 252.27 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-methyl-4-pyridin-4-ylquinolin-2-one is sourced from PubChem (CID 137027848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).