7-methoxyquinoline-3-carboxylate;triethylazanium

C17H24N2O3 — CID 129247666

IUPAC7-methoxyquinoline-3-carboxylate;triethylazanium
SMILESCC[NH+](CC)CC.COc1ccc2cc(C(=O)[O-])cnc2c1
InChIInChI=1S/C11H9NO3.C6H15N/c1-15-9-3-2-7-4-8(11(13)14)6-12-10(7)5-9;1-4-7(5-2)6-3/h2-6H,1H3,(H,13,14);4-6H2,1-3H3
InChIKeyUQPGFZOORKZTRC-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.54
Rot. Bonds5

About 7-methoxyquinoline-3-carboxylate;triethylazanium

7-methoxyquinoline-3-carboxylate;triethylazanium (PubChem CID 129247666) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 7-methoxyquinoline-3-carboxylate;triethylazanium.

Molecular Properties

Compound Name7-methoxyquinoline-3-carboxylate;triethylazanium
PubChem CID129247666
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name7-methoxyquinoline-3-carboxylate;triethylazanium
SMILESCC[NH+](CC)CC.COc1ccc2cc(C(=O)[O-])cnc2c1
InChIInChI=1S/C11H9NO3.C6H15N/c1-15-9-3-2-7-4-8(11(13)14)6-12-10(7)5-9;1-4-7(5-2)6-3/h2-6H,1H3,(H,13,14);4-6H2,1-3H3
InChIKeyUQPGFZOORKZTRC-UHFFFAOYSA-N
XLogP0.54
TPSA66.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 7-methoxyquinoline-3-carboxylate;hydrochloride
CID 22326874
7-methoxy-N-pentan-3-ylquinoline-3-carboxamide
CID 129276017
methyl 2-[(7-methoxyquinoline-3-carbonyl)amino]acetate
CID 110489898
7-methoxy-N-(2-methylpropyl)quinoline-3-carboxamide
CID 110489915
ethyl 2-(7-methoxyquinolin-3-yl)acetate
CID 90417413
ethyl 7-methoxyquinoline-3-carboxylate;methyl 7-hydroxyquinoline-3-carboxylate
CID 158875379
3-ethyl-7-methoxyquinoline
CID 14361549
N-[(2S)-1-amino-1-oxopropan-2-yl]-7-methoxyquinoline-3-carboxamide
CID 155544242
quinoline-3-carboxylate
CID 4608508
7-methoxy-N-(1H-1,2,4-triazol-5-yl)quinoline-3-carboxamide
CID 110489890
3-bromo-7-methoxyquinoline
CID 18788548
methyl 3-(6-methoxyquinolin-3-yl)-3-oxopropanoate
CID 82665608

Frequently Asked Questions

What is the IUPAC name of 7-methoxyquinoline-3-carboxylate;triethylazanium?
The IUPAC name of 7-methoxyquinoline-3-carboxylate;triethylazanium (CID 129247666) is 7-methoxyquinoline-3-carboxylate;triethylazanium.
What is the SMILES notation for 7-methoxyquinoline-3-carboxylate;triethylazanium?
The canonical SMILES for 7-methoxyquinoline-3-carboxylate;triethylazanium is CC[NH+](CC)CC.COc1ccc2cc(C(=O)[O-])cnc2c1.
What is the InChIKey of 7-methoxyquinoline-3-carboxylate;triethylazanium?
The InChIKey is UQPGFZOORKZTRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO3.C6H15N/c1-15-9-3-2-7-4-8(11(13)14)6-12-10(7)5-9;1-4-7(5-2)6-3/h2-6H,1H3,(H,13,14);4-6H2,1-3H3.
What are the key properties of 7-methoxyquinoline-3-carboxylate;triethylazanium?
7-methoxyquinoline-3-carboxylate;triethylazanium has a molecular weight of 304.39 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxyquinoline-3-carboxylate;triethylazanium is sourced from PubChem (CID 129247666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).