6,7,8-trimethoxy-1,4-dimethylquinolin-2-one

C14H17NO4 — CID 42618033

IUPAC6,7,8-trimethoxy-1,4-dimethylquinolin-2-one
SMILESCOc1cc2c(C)cc(=O)n(C)c2c(OC)c1OC
InChIInChI=1S/C14H17NO4/c1-8-6-11(16)15(2)12-9(8)7-10(17-3)13(18-4)14(12)19-5/h6-7H,1-5H3
InChIKeyQKOJIFYKROBOKN-UHFFFAOYSA-N
MW263.29 g/mol
LogP1.87
Rot. Bonds3

About 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one

6,7,8-trimethoxy-1,4-dimethylquinolin-2-one (PubChem CID 42618033) has the molecular formula C14H17NO4 and a molecular weight of 263.29 g/mol. Its IUPAC name is 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one.

Molecular Properties

Compound Name6,7,8-trimethoxy-1,4-dimethylquinolin-2-one
PubChem CID42618033
Molecular FormulaC14H17NO4
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name6,7,8-trimethoxy-1,4-dimethylquinolin-2-one
SMILESCOc1cc2c(C)cc(=O)n(C)c2c(OC)c1OC
InChIInChI=1S/C14H17NO4/c1-8-6-11(16)15(2)12-9(8)7-10(17-3)13(18-4)14(12)19-5/h6-7H,1-5H3
InChIKeyQKOJIFYKROBOKN-UHFFFAOYSA-N
XLogP1.87
TPSA49.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-Methoxy-9-methyl-(1,3)dioxolo(4,5-h)quinolin-8(9H)-one
CID 124075
5,6,8-Trimethoxy-1,4-dimethylquinolin-2(1H)-one
CID 15306617
6,8-Dimethoxy-1,4-dimethylquinolin-2(1H)-one
CID 42618031
5,6,7,8-Tetramethoxy-1,4-dimethylquinolin-2-one
CID 42618035
5,6,8-Trimethoxy-4-methylquinolin-2(1H)-one
CID 15306616
6,9-Dimethyl[1,3]dioxolo[4,5-H]quinolin-8(9h)-One
CID 42618027
7,8-Dimethoxy-1,4-dimethylquinolin-2(1H)-one
CID 42618029
6,7,8-Trimethoxy-4-methylquinolin-2(1H)-one
CID 42618032
5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one
CID 42618034
Veprisine
CID 338941
Preskimmianine
CID 12305721
7,8-dimethoxy-4-methyl-1H-quinolin-2-one
CID 42618028

Frequently Asked Questions

What is the IUPAC name of 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one?
The IUPAC name of 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one (CID 42618033) is 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one.
What is the SMILES notation for 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one?
The canonical SMILES for 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one is COc1cc2c(C)cc(=O)n(C)c2c(OC)c1OC.
What is the InChIKey of 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one?
The InChIKey is QKOJIFYKROBOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO4/c1-8-6-11(16)15(2)12-9(8)7-10(17-3)13(18-4)14(12)19-5/h6-7H,1-5H3.
What are the key properties of 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one?
6,7,8-trimethoxy-1,4-dimethylquinolin-2-one has a molecular weight of 263.29 g/mol, XLogP of 1.87, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8-trimethoxy-1,4-dimethylquinolin-2-one is sourced from PubChem (CID 42618033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).