methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate

C20H16N2O4 — CID 22936605

IUPACmethyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate
SMILESCOC(=O)c1cc2c(Oc3ccc4[nH]ccc4c3)ccnc2cc1OC
InChIInChI=1S/C20H16N2O4/c1-24-19-11-17-14(10-15(19)20(23)25-2)18(6-8-22-17)26-13-3-4-16-12(9-13)5-7-21-16/h3-11,21H,1-2H3
InChIKeyMEILBAPHMRGDIT-UHFFFAOYSA-N
MW348.36 g/mol
LogP4.30
Rot. Bonds4

About methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate

methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate (PubChem CID 22936605) has the molecular formula C20H16N2O4 and a molecular weight of 348.36 g/mol. Its IUPAC name is methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate.

Molecular Properties

Compound Namemethyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate
PubChem CID22936605
Molecular FormulaC20H16N2O4
Molecular Weight348.36 g/mol
Exact Mass348.11
IUPAC Namemethyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate
SMILESCOC(=O)c1cc2c(Oc3ccc4[nH]ccc4c3)ccnc2cc1OC
InChIInChI=1S/C20H16N2O4/c1-24-19-11-17-14(10-15(19)20(23)25-2)18(6-8-22-17)26-13-3-4-16-12(9-13)5-7-21-16/h3-11,21H,1-2H3
InChIKeyMEILBAPHMRGDIT-UHFFFAOYSA-N
XLogP4.30
TPSA73.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-(4-amino-3-methylphenoxy)-7-methoxyquinoline-6-carboxylate
CID 22936380
[2-chloro-4-(7-methoxy-6-methoxycarbonylquinolin-4-yl)oxyphenyl]carbamic acid
CID 68668429
4-(1H-indol-5-yloxy)-6-isocyanoquinolin-7-ol
CID 135989965
4-(4-amino-3-methylphenoxy)-7-methoxyquinoline-6-carboxylic acid
CID 141052127
methyl 3-(6,7-dimethoxyquinolin-4-yl)oxybenzoate
CID 71377074
7-methoxy-4-(3-methoxyphenoxy)-N-methylquinoline-6-carboxamide
CID 69131598
methyl 4-[3-chloro-4-[(3,3-difluoroazetidine-1-carbothioyl)amino]phenoxy]-7-methoxyquinoline-6-carboxylate
CID 134333805
methyl 4-(2-fluoro-4-nitrophenoxy)-7-methoxyquinoline-6-carboxylate
CID 66916355
methyl 4-[4-[2-[1-[2-(4-fluorophenyl)acetyl]cyclopropyl]-2-oxoethyl]phenoxy]-6-methoxyquinoline-7-carboxylate
CID 159464647
6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-1-carboxamide
CID 11474276
7-methoxy-N-methyl-4-(4-nitrosophenoxy)quinoline-6-carboxamide
CID 88925531
methyl 6,7-dimethoxyquinoline-4-carboxylate
CID 59756874

Frequently Asked Questions

What is the IUPAC name of methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate?
The IUPAC name of methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate (CID 22936605) is methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate.
What is the SMILES notation for methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate?
The canonical SMILES for methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate is COC(=O)c1cc2c(Oc3ccc4[nH]ccc4c3)ccnc2cc1OC.
What is the InChIKey of methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate?
The InChIKey is MEILBAPHMRGDIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O4/c1-24-19-11-17-14(10-15(19)20(23)25-2)18(6-8-22-17)26-13-3-4-16-12(9-13)5-7-21-16/h3-11,21H,1-2H3.
What are the key properties of methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate?
methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate has a molecular weight of 348.36 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(1H-indol-5-yloxy)-7-methoxyquinoline-6-carboxylate is sourced from PubChem (CID 22936605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).