4-hydroxy-1-methylquinolin-2-one

C10H9NO2 — CID 54686436

IUPAC4-hydroxy-1-methylquinolin-2-one
SMILESCn1c(=O)cc(O)c2ccccc21
InChIInChI=1S/C10H9NO2/c1-11-8-5-3-2-4-7(8)9(12)6-10(11)13/h2-6,12H,1H3
InChIKeyRTNPPPQVXREFKX-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.24
Rot. Bonds

About 4-hydroxy-1-methylquinolin-2-one

4-hydroxy-1-methylquinolin-2-one (PubChem CID 54686436) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-hydroxy-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-methylquinolin-2-one
PubChem CID54686436
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name4-hydroxy-1-methylquinolin-2-one
SMILESCn1c(=O)cc(O)c2ccccc21
InChIInChI=1S/C10H9NO2/c1-11-8-5-3-2-4-7(8)9(12)6-10(11)13/h2-6,12H,1H3
InChIKeyRTNPPPQVXREFKX-UHFFFAOYSA-N
XLogP1.24
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-methylquinolin-2-one?
The IUPAC name of 4-hydroxy-1-methylquinolin-2-one (CID 54686436) is 4-hydroxy-1-methylquinolin-2-one.
What is the SMILES notation for 4-hydroxy-1-methylquinolin-2-one?
The canonical SMILES for 4-hydroxy-1-methylquinolin-2-one is Cn1c(=O)cc(O)c2ccccc21.
What is the InChIKey of 4-hydroxy-1-methylquinolin-2-one?
The InChIKey is RTNPPPQVXREFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-11-8-5-3-2-4-7(8)9(12)6-10(11)13/h2-6,12H,1H3.
What are the key properties of 4-hydroxy-1-methylquinolin-2-one?
4-hydroxy-1-methylquinolin-2-one has a molecular weight of 175.19 g/mol, XLogP of 1.24, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-methylquinolin-2-one is sourced from PubChem (CID 54686436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).