4-(1H-indol-5-yloxymethyl)quinoline

C18H14N2O — CID 80648654

IUPAC4-(1H-indol-5-yloxymethyl)quinoline
SMILESc1ccc2c(COc3ccc4[nH]ccc4c3)ccnc2c1
InChIInChI=1S/C18H14N2O/c1-2-4-18-16(3-1)14(8-10-20-18)12-21-15-5-6-17-13(11-15)7-9-19-17/h1-11,19H,12H2
InChIKeyNEKFFBWNNOFPJV-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.30
Rot. Bonds3

About 4-(1H-indol-5-yloxymethyl)quinoline

4-(1H-indol-5-yloxymethyl)quinoline (PubChem CID 80648654) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-(1H-indol-5-yloxymethyl)quinoline.

Molecular Properties

Compound Name4-(1H-indol-5-yloxymethyl)quinoline
PubChem CID80648654
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name4-(1H-indol-5-yloxymethyl)quinoline
SMILESc1ccc2c(COc3ccc4[nH]ccc4c3)ccnc2c1
InChIInChI=1S/C18H14N2O/c1-2-4-18-16(3-1)14(8-10-20-18)12-21-15-5-6-17-13(11-15)7-9-19-17/h1-11,19H,12H2
InChIKeyNEKFFBWNNOFPJV-UHFFFAOYSA-N
XLogP4.30
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-indol-5-yloxymethyl)quinoline?
The IUPAC name of 4-(1H-indol-5-yloxymethyl)quinoline (CID 80648654) is 4-(1H-indol-5-yloxymethyl)quinoline.
What is the SMILES notation for 4-(1H-indol-5-yloxymethyl)quinoline?
The canonical SMILES for 4-(1H-indol-5-yloxymethyl)quinoline is c1ccc2c(COc3ccc4[nH]ccc4c3)ccnc2c1.
What is the InChIKey of 4-(1H-indol-5-yloxymethyl)quinoline?
The InChIKey is NEKFFBWNNOFPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-2-4-18-16(3-1)14(8-10-20-18)12-21-15-5-6-17-13(11-15)7-9-19-17/h1-11,19H,12H2.
What are the key properties of 4-(1H-indol-5-yloxymethyl)quinoline?
4-(1H-indol-5-yloxymethyl)quinoline has a molecular weight of 274.32 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indol-5-yloxymethyl)quinoline is sourced from PubChem (CID 80648654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).