3-(2,3-dihydro-1H-indol-4-yl)quinoline

C17H14N2 — CID 116698310

IUPAC3-(2,3-dihydro-1H-indol-4-yl)quinoline
SMILESc1cc2c(c(-c3cnc4ccccc4c3)c1)CCN2
InChIInChI=1S/C17H14N2/c1-2-6-16-12(4-1)10-13(11-19-16)14-5-3-7-17-15(14)8-9-18-17/h1-7,10-11,18H,8-9H2
InChIKeyRSCMOLOSWLCQDR-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.87
Rot. Bonds1

About 3-(2,3-dihydro-1H-indol-4-yl)quinoline

3-(2,3-dihydro-1H-indol-4-yl)quinoline (PubChem CID 116698310) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-indol-4-yl)quinoline.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-indol-4-yl)quinoline
PubChem CID116698310
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name3-(2,3-dihydro-1H-indol-4-yl)quinoline
SMILESc1cc2c(c(-c3cnc4ccccc4c3)c1)CCN2
InChIInChI=1S/C17H14N2/c1-2-6-16-12(4-1)10-13(11-19-16)14-5-3-7-17-15(14)8-9-18-17/h1-7,10-11,18H,8-9H2
InChIKeyRSCMOLOSWLCQDR-UHFFFAOYSA-N
XLogP3.87
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-indol-4-yl)quinoline?
The IUPAC name of 3-(2,3-dihydro-1H-indol-4-yl)quinoline (CID 116698310) is 3-(2,3-dihydro-1H-indol-4-yl)quinoline.
What is the SMILES notation for 3-(2,3-dihydro-1H-indol-4-yl)quinoline?
The canonical SMILES for 3-(2,3-dihydro-1H-indol-4-yl)quinoline is c1cc2c(c(-c3cnc4ccccc4c3)c1)CCN2.
What is the InChIKey of 3-(2,3-dihydro-1H-indol-4-yl)quinoline?
The InChIKey is RSCMOLOSWLCQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-2-6-16-12(4-1)10-13(11-19-16)14-5-3-7-17-15(14)8-9-18-17/h1-7,10-11,18H,8-9H2.
What are the key properties of 3-(2,3-dihydro-1H-indol-4-yl)quinoline?
3-(2,3-dihydro-1H-indol-4-yl)quinoline has a molecular weight of 246.31 g/mol, XLogP of 3.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-indol-4-yl)quinoline is sourced from PubChem (CID 116698310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).