5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol

C19H16N2O — CID 58171425

IUPAC5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol
SMILESOc1ccc(CCc2c[nH]c3ccccc23)c2cccnc12
InChIInChI=1S/C19H16N2O/c22-18-10-9-13(16-5-3-11-20-19(16)18)7-8-14-12-21-17-6-2-1-4-15(14)17/h1-6,9-12,21-22H,7-8H2
InChIKeySCCGJEJJQJWGNC-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.21
Rot. Bonds3

About 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol

5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol (PubChem CID 58171425) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol.

Molecular Properties

Compound Name5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol
PubChem CID58171425
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol
SMILESOc1ccc(CCc2c[nH]c3ccccc23)c2cccnc12
InChIInChI=1S/C19H16N2O/c22-18-10-9-13(16-5-3-11-20-19(16)18)7-8-14-12-21-17-6-2-1-4-15(14)17/h1-6,9-12,21-22H,7-8H2
InChIKeySCCGJEJJQJWGNC-UHFFFAOYSA-N
XLogP4.21
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol?
The IUPAC name of 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol (CID 58171425) is 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol.
What is the SMILES notation for 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol?
The canonical SMILES for 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol is Oc1ccc(CCc2c[nH]c3ccccc23)c2cccnc12.
What is the InChIKey of 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol?
The InChIKey is SCCGJEJJQJWGNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c22-18-10-9-13(16-5-3-11-20-19(16)18)7-8-14-12-21-17-6-2-1-4-15(14)17/h1-6,9-12,21-22H,7-8H2.
What are the key properties of 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol?
5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol has a molecular weight of 288.35 g/mol, XLogP of 4.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1H-indol-3-yl)ethyl]quinolin-8-ol is sourced from PubChem (CID 58171425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).