methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate

C14H15NO5 — CID 142737203

IUPACmethyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate
SMILESCOC(=O)c1cc(=O)c2c(OC)ccc(OC)c2n1C
InChIInChI=1S/C14H15NO5/c1-15-8(14(17)20-4)7-9(16)12-10(18-2)5-6-11(19-3)13(12)15/h5-7H,1-4H3
InChIKeyFAAWHKCBHCKFJB-UHFFFAOYSA-N
MW277.28 g/mol
LogP1.34
Rot. Bonds3

About methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate

methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate (PubChem CID 142737203) has the molecular formula C14H15NO5 and a molecular weight of 277.28 g/mol. Its IUPAC name is methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate.

Molecular Properties

Compound Namemethyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate
PubChem CID142737203
Molecular FormulaC14H15NO5
Molecular Weight277.28 g/mol
Exact Mass277.10
IUPAC Namemethyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate
SMILESCOC(=O)c1cc(=O)c2c(OC)ccc(OC)c2n1C
InChIInChI=1S/C14H15NO5/c1-15-8(14(17)20-4)7-9(16)12-10(18-2)5-6-11(19-3)13(12)15/h5-7H,1-4H3
InChIKeyFAAWHKCBHCKFJB-UHFFFAOYSA-N
XLogP1.34
TPSA66.76 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4,7-dimethoxy-1-methylindole-2-carboxylate
CID 4777665
methyl 7-methoxy-1,4-dimethylindole-2-carboxylate
CID 132843169
N-(3,5-ditert-butylphenyl)-5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxamide
CID 142737199
N-benzyl-5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxamide
CID 142737210
methyl 5,7-dimethoxy-1-methylindole-2-carboxylate
CID 102511974
methyl 4-chloro-5-methoxy-1-methylindole-2-carboxylate
CID 130408728
2-(4,7-dimethoxy-1,2-dimethylindol-3-yl)acetic acid
CID 82501280
4,7-dimethoxy-1-methylindole-2-carboxylate
CID 6953965
1-(4,7-dimethoxy-1,2-dimethylindol-3-yl)ethanone
CID 82498460
methyl 4-[2-(aminomethyl)pentoxy]-7-methoxy-1-methylindole-2-carboxylate
CID 141320002
5-chloro-1-(2-hydroxyethyl)-8-methoxy-4-oxoquinoline-2-carboxylic acid
CID 82251962
methyl 5-methoxy-8-methyl-4-oxo-1H-quinoline-2-carboxylate
CID 114252907

Frequently Asked Questions

What is the IUPAC name of methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate?
The IUPAC name of methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate (CID 142737203) is methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate.
What is the SMILES notation for methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate?
The canonical SMILES for methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate is COC(=O)c1cc(=O)c2c(OC)ccc(OC)c2n1C.
What is the InChIKey of methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate?
The InChIKey is FAAWHKCBHCKFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO5/c1-15-8(14(17)20-4)7-9(16)12-10(18-2)5-6-11(19-3)13(12)15/h5-7H,1-4H3.
What are the key properties of methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate?
methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate has a molecular weight of 277.28 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5,8-dimethoxy-1-methyl-4-oxoquinoline-2-carboxylate is sourced from PubChem (CID 142737203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).