ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate

C14H15NO4 — CID 13064085

IUPACethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate
SMILESCCOC(=O)Cc1cc(=O)c2ccc(OC)cc2[nH]1
InChIInChI=1S/C14H15NO4/c1-3-19-14(17)7-9-6-13(16)11-5-4-10(18-2)8-12(11)15-9/h4-6,8H,3,7H2,1-2H3,(H,15,16)
InChIKeyUGARVZVFHSJMQY-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.64
Rot. Bonds4

About ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate

ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate (PubChem CID 13064085) has the molecular formula C14H15NO4 and a molecular weight of 261.28 g/mol. Its IUPAC name is ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate
PubChem CID13064085
Molecular FormulaC14H15NO4
Molecular Weight261.28 g/mol
Exact Mass261.10
IUPAC Nameethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate
SMILESCCOC(=O)Cc1cc(=O)c2ccc(OC)cc2[nH]1
InChIInChI=1S/C14H15NO4/c1-3-19-14(17)7-9-6-13(16)11-5-4-10(18-2)8-12(11)15-9/h4-6,8H,3,7H2,1-2H3,(H,15,16)
InChIKeyUGARVZVFHSJMQY-UHFFFAOYSA-N
XLogP1.64
TPSA68.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-methoxy-4-oxo-1H-quinolin-2-yl)acetamide
CID 25174598
2-acetyl-7-methoxy-1H-quinolin-4-one
CID 59108287
ethyl 2-(6-methoxynaphthalen-2-yl)acetate
CID 11265053
ethyl 2-(6-methoxy-3-methyl-1H-indol-2-yl)-2-oxoacetate
CID 115072762
ethyl 3-(2-ethoxy-2-oxoethyl)-5-methoxy-1H-indole-2-carboxylate
CID 10590673
2-(6-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 70238324
ethyl 2-(2,7-dimethoxyanthracen-9-yl)acetate
CID 132539637
ethyl 2-[2-(1-aminoethyl)-5-methoxy-1H-indol-3-yl]acetate
CID 70508513
ethyl 2-[6-(trideuteriomethoxy)-1H-indol-3-yl]acetate
CID 168930983
N-(4-methoxyphenyl)-2-[(7-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide
CID 46355420
ethyl 6-methoxy-4H-furo[3,2-b]indole-2-carboxylate
CID 13405782
methyl 2-ethyl-4-oxo-1H-quinoline-7-carboxylate
CID 126753254

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate?
The IUPAC name of ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate (CID 13064085) is ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate.
What is the SMILES notation for ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate?
The canonical SMILES for ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate is CCOC(=O)Cc1cc(=O)c2ccc(OC)cc2[nH]1.
What is the InChIKey of ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate?
The InChIKey is UGARVZVFHSJMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4/c1-3-19-14(17)7-9-6-13(16)11-5-4-10(18-2)8-12(11)15-9/h4-6,8H,3,7H2,1-2H3,(H,15,16).
What are the key properties of ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate?
ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate has a molecular weight of 261.28 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(7-methoxy-4-oxo-1H-quinolin-2-yl)acetate is sourced from PubChem (CID 13064085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).