methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate

C14H15NO4 — CID 53269611

IUPACmethyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate
SMILESCOC(=O)C(C)n1ccc(=O)c2cc(OC)ccc21
InChIInChI=1S/C14H15NO4/c1-9(14(17)19-3)15-7-6-13(16)11-8-10(18-2)4-5-12(11)15/h4-9H,1-3H3
InChIKeyFKRMSMYZJNJGLO-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.74
Rot. Bonds3

About methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate

methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate (PubChem CID 53269611) has the molecular formula C14H15NO4 and a molecular weight of 261.28 g/mol. Its IUPAC name is methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate.

Molecular Properties

Compound Namemethyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate
PubChem CID53269611
Molecular FormulaC14H15NO4
Molecular Weight261.28 g/mol
Exact Mass261.10
IUPAC Namemethyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate
SMILESCOC(=O)C(C)n1ccc(=O)c2cc(OC)ccc21
InChIInChI=1S/C14H15NO4/c1-9(14(17)19-3)15-7-6-13(16)11-8-10(18-2)4-5-12(11)15/h4-9H,1-3H3
InChIKeyFKRMSMYZJNJGLO-UHFFFAOYSA-N
XLogP1.74
TPSA57.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(4-fluoroindol-1-yl)propanoate
CID 59466070
methyl (2S)-2-(5-bromoindol-1-yl)propanoate
CID 118001554
methyl 2-(8-ethoxy-4-oxoquinolin-1-yl)propanoate
CID 66487387
methyl 1-(1-methoxy-1-oxopropan-2-yl)-2-oxopyridine-4-carboxylate
CID 46868567
2-(5-methoxy-1-propan-2-ylindol-3-yl)propanoic acid
CID 117121168
methyl 2-(3-methoxyindol-1-yl)propanoate
CID 162779328
N-[2-(5-methoxy-1-propan-2-ylindol-3-yl)ethyl]acetamide
CID 86078316
2-(5-methoxyindol-1-yl)-4-methylpentanoic acid
CID 114282497
(2R)-2-(5-methoxyindol-1-yl)-4-methylpentanoic acid
CID 114282498
2-(5-methoxyindol-1-yl)-N-(1-propan-2-ylindol-4-yl)acetamide
CID 56763610
methyl 2-(7-chloroindol-1-yl)propanoate
CID 103474207
2-(6-chloro-4-oxoquinolin-1-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 100734852

Frequently Asked Questions

What is the IUPAC name of methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate?
The IUPAC name of methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate (CID 53269611) is methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate.
What is the SMILES notation for methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate?
The canonical SMILES for methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate is COC(=O)C(C)n1ccc(=O)c2cc(OC)ccc21.
What is the InChIKey of methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate?
The InChIKey is FKRMSMYZJNJGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4/c1-9(14(17)19-3)15-7-6-13(16)11-8-10(18-2)4-5-12(11)15/h4-9H,1-3H3.
What are the key properties of methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate?
methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate has a molecular weight of 261.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(6-methoxy-4-oxoquinolin-1-yl)propanoate is sourced from PubChem (CID 53269611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).