4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide

C18H16N2O5 — CID 118310234

IUPAC4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide
SMILESCOc1cc2[nH]c(=O)cc(Oc3ccc(C(N)=O)cc3)c2cc1OC
InChIInChI=1S/C18H16N2O5/c1-23-15-7-12-13(8-16(15)24-2)20-17(21)9-14(12)25-11-5-3-10(4-6-11)18(19)22/h3-9H,1-2H3,(H2,19,22)(H,20,21)
InChIKeyLAQOTYLWMUJKJC-UHFFFAOYSA-N
MW340.34 g/mol
LogP2.44
Rot. Bonds5

About 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide

4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide (PubChem CID 118310234) has the molecular formula C18H16N2O5 and a molecular weight of 340.34 g/mol. Its IUPAC name is 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide.

Molecular Properties

Compound Name4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide
PubChem CID118310234
Molecular FormulaC18H16N2O5
Molecular Weight340.34 g/mol
Exact Mass340.11
IUPAC Name4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide
SMILESCOc1cc2[nH]c(=O)cc(Oc3ccc(C(N)=O)cc3)c2cc1OC
InChIInChI=1S/C18H16N2O5/c1-23-15-7-12-13(8-16(15)24-2)20-17(21)9-14(12)25-11-5-3-10(4-6-11)18(19)22/h3-9H,1-2H3,(H2,19,22)(H,20,21)
InChIKeyLAQOTYLWMUJKJC-UHFFFAOYSA-N
XLogP2.44
TPSA103.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide?
The IUPAC name of 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide (CID 118310234) is 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide.
What is the SMILES notation for 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide?
The canonical SMILES for 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide is COc1cc2[nH]c(=O)cc(Oc3ccc(C(N)=O)cc3)c2cc1OC.
What is the InChIKey of 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide?
The InChIKey is LAQOTYLWMUJKJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O5/c1-23-15-7-12-13(8-16(15)24-2)20-17(21)9-14(12)25-11-5-3-10(4-6-11)18(19)22/h3-9H,1-2H3,(H2,19,22)(H,20,21).
What are the key properties of 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide?
4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide has a molecular weight of 340.34 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6,7-dimethoxy-2-oxo-1H-quinolin-4-yl)oxy]benzamide is sourced from PubChem (CID 118310234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).