5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one

C14H17NO5 — CID 42618034

IUPAC5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one
SMILESCOc1c(OC)c(OC)c2c(C)cc(=O)[nH]c2c1OC
InChIInChI=1S/C14H17NO5/c1-7-6-8(16)15-10-9(7)11(17-2)13(19-4)14(20-5)12(10)18-3/h6H,1-5H3,(H,15,16)
InChIKeyUWSNOYGRNSLKPY-UHFFFAOYSA-N
MW279.29 g/mol
LogP1.87
Rot. Bonds4

About 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one

5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one (PubChem CID 42618034) has the molecular formula C14H17NO5 and a molecular weight of 279.29 g/mol. Its IUPAC name is 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one
PubChem CID42618034
Molecular FormulaC14H17NO5
Molecular Weight279.29 g/mol
Exact Mass279.11
IUPAC Name5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one
SMILESCOc1c(OC)c(OC)c2c(C)cc(=O)[nH]c2c1OC
InChIInChI=1S/C14H17NO5/c1-7-6-8(16)15-10-9(7)11(17-2)13(19-4)14(20-5)12(10)18-3/h6H,1-5H3,(H,15,16)
InChIKeyUWSNOYGRNSLKPY-UHFFFAOYSA-N
XLogP1.87
TPSA69.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one?
The IUPAC name of 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one (CID 42618034) is 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one.
What is the SMILES notation for 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one?
The canonical SMILES for 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one is COc1c(OC)c(OC)c2c(C)cc(=O)[nH]c2c1OC.
What is the InChIKey of 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one?
The InChIKey is UWSNOYGRNSLKPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO5/c1-7-6-8(16)15-10-9(7)11(17-2)13(19-4)14(20-5)12(10)18-3/h6H,1-5H3,(H,15,16).
What are the key properties of 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one?
5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one has a molecular weight of 279.29 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetramethoxy-4-methyl-1H-quinolin-2-one is sourced from PubChem (CID 42618034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).