3-hydroxy-1H-quinolin-2-one

C18H14N2O4 — CID 162237175

IUPAC3-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1O.O=c1[nH]c2ccccc2cc1O
InChIInChI=1S/2C9H7NO2/c2*11-8-5-6-3-1-2-4-7(6)10-9(8)12/h2*1-5,11H,(H,10,12)
InChIKeyZWFGDEOQYHMFEN-UHFFFAOYSA-N
MW322.32 g/mol
LogP2.47
Rot. Bonds

About 3-hydroxy-1H-quinolin-2-one

3-hydroxy-1H-quinolin-2-one (PubChem CID 162237175) has the molecular formula C18H14N2O4 and a molecular weight of 322.32 g/mol. Its IUPAC name is 3-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name3-hydroxy-1H-quinolin-2-one
PubChem CID162237175
Molecular FormulaC18H14N2O4
Molecular Weight322.32 g/mol
Exact Mass322.10
IUPAC Name3-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1O.O=c1[nH]c2ccccc2cc1O
InChIInChI=1S/2C9H7NO2/c2*11-8-5-6-3-1-2-4-7(6)10-9(8)12/h2*1-5,11H,(H,10,12)
InChIKeyZWFGDEOQYHMFEN-UHFFFAOYSA-N
XLogP2.47
TPSA106.18 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.32
LogP ≤ 52.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-1H-quinolin-2-one
CID 818159
3-(3-hydroxynaphthalene-2-carbonyl)-1H-quinolin-2-one
CID 628875
3-(18F)fluoro-1H-quinolin-2-one
CID 158117840
copper bis(2-oxo-1H-quinolin-3-olate)
CID 67199859
3-[(2-hydroxyanilino)methyl]-1H-quinolin-2-one
CID 46950057
3-(3-hydroxyphenyl)-1H-quinolin-2-one
CID 11989516
3-nitroso-1H-quinolin-2-one
CID 22103970
3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide
CID 135937902
3-(dichloromethyl)-1H-quinolin-2-one
CID 15208670
N-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 16613028
N,N-dimethyl-2-oxo-1H-quinoline-3-carboxamide
CID 14117619
8-chloro-3-hydroxy-1H-quinolin-2-one
CID 13271054

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1H-quinolin-2-one?
The IUPAC name of 3-hydroxy-1H-quinolin-2-one (CID 162237175) is 3-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 3-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 3-hydroxy-1H-quinolin-2-one is O=c1[nH]c2ccccc2cc1O.O=c1[nH]c2ccccc2cc1O.
What is the InChIKey of 3-hydroxy-1H-quinolin-2-one?
The InChIKey is ZWFGDEOQYHMFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H7NO2/c2*11-8-5-6-3-1-2-4-7(6)10-9(8)12/h2*1-5,11H,(H,10,12).
What are the key properties of 3-hydroxy-1H-quinolin-2-one?
3-hydroxy-1H-quinolin-2-one has a molecular weight of 322.32 g/mol, XLogP of 2.47, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 162237175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).