2-(1H-indol-3-yl)-6-methoxyquinoline

C18H14N2O — CID 18729469

IUPAC2-(1H-indol-3-yl)-6-methoxyquinoline
SMILESCOc1ccc2nc(-c3c[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C18H14N2O/c1-21-13-7-9-16-12(10-13)6-8-18(20-16)15-11-19-17-5-3-2-4-14(15)17/h2-11,19H,1H3
InChIKeyUGJJVZWIGZITKT-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.39
Rot. Bonds2

About 2-(1H-indol-3-yl)-6-methoxyquinoline

2-(1H-indol-3-yl)-6-methoxyquinoline (PubChem CID 18729469) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-6-methoxyquinoline.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-6-methoxyquinoline
PubChem CID18729469
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name2-(1H-indol-3-yl)-6-methoxyquinoline
SMILESCOc1ccc2nc(-c3c[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C18H14N2O/c1-21-13-7-9-16-12(10-13)6-8-18(20-16)15-11-19-17-5-3-2-4-14(15)17/h2-11,19H,1H3
InChIKeyUGJJVZWIGZITKT-UHFFFAOYSA-N
XLogP4.39
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-6-methoxyquinoline?
The IUPAC name of 2-(1H-indol-3-yl)-6-methoxyquinoline (CID 18729469) is 2-(1H-indol-3-yl)-6-methoxyquinoline.
What is the SMILES notation for 2-(1H-indol-3-yl)-6-methoxyquinoline?
The canonical SMILES for 2-(1H-indol-3-yl)-6-methoxyquinoline is COc1ccc2nc(-c3c[nH]c4ccccc34)ccc2c1.
What is the InChIKey of 2-(1H-indol-3-yl)-6-methoxyquinoline?
The InChIKey is UGJJVZWIGZITKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-21-13-7-9-16-12(10-13)6-8-18(20-16)15-11-19-17-5-3-2-4-14(15)17/h2-11,19H,1H3.
What are the key properties of 2-(1H-indol-3-yl)-6-methoxyquinoline?
2-(1H-indol-3-yl)-6-methoxyquinoline has a molecular weight of 274.32 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-6-methoxyquinoline is sourced from PubChem (CID 18729469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).