8-(2,3-dihydro-1H-isoindol-1-yl)quinoline

C17H14N2 — CID 81224395

IUPAC8-(2,3-dihydro-1H-isoindol-1-yl)quinoline
SMILESc1ccc2c(c1)CNC2c1cccc2cccnc12
InChIInChI=1S/C17H14N2/c1-2-8-14-13(5-1)11-19-17(14)15-9-3-6-12-7-4-10-18-16(12)15/h1-10,17,19H,11H2
InChIKeyQSTGXFAOEBXDGX-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.43
Rot. Bonds1

About 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline

8-(2,3-dihydro-1H-isoindol-1-yl)quinoline (PubChem CID 81224395) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline.

Molecular Properties

Compound Name8-(2,3-dihydro-1H-isoindol-1-yl)quinoline
PubChem CID81224395
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name8-(2,3-dihydro-1H-isoindol-1-yl)quinoline
SMILESc1ccc2c(c1)CNC2c1cccc2cccnc12
InChIInChI=1S/C17H14N2/c1-2-8-14-13(5-1)11-19-17(14)15-9-3-6-12-7-4-10-18-16(12)15/h1-10,17,19H,11H2
InChIKeyQSTGXFAOEBXDGX-UHFFFAOYSA-N
XLogP3.43
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 ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,3-dihydro-1H-isoindol-1-yl)quinoline
CID 81224318
8-cyclopropylquinoline
CID 66823369
1-(1-benzothiophen-7-yl)-2,3-dihydro-1H-isoindole
CID 81146996
(1R)-1-pyridin-3-yl-2,3-dihydro-1H-isoindole
CID 177219714
8-[(2S)-pyrrolidin-2-yl]quinoline;dihydrochloride
CID 154574794
8-pyrrolidin-3-ylquinoline;hydrochloride
CID 169498293
2,3-dihydro-1H-isoindol-1-yl(quinolin-6-yl)methanol
CID 65041727
5-bromo-7-(1,2,3,4-tetrahydroisoquinolin-1-yl)quinolin-8-ol
CID 131987057
2-quinolin-8-ylcyclohexan-1-amine
CID 81224075
N-(2,3-dihydro-1H-inden-2-yl)quinolin-8-amine
CID 43512766
8-(2-chlorocycloheptyl)quinoline
CID 81223913
8-(3-bromocycloheptyl)quinoline
CID 81221251

Frequently Asked Questions

What is the IUPAC name of 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline?
The IUPAC name of 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline (CID 81224395) is 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline.
What is the SMILES notation for 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline?
The canonical SMILES for 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline is c1ccc2c(c1)CNC2c1cccc2cccnc12.
What is the InChIKey of 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline?
The InChIKey is QSTGXFAOEBXDGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-2-8-14-13(5-1)11-19-17(14)15-9-3-6-12-7-4-10-18-16(12)15/h1-10,17,19H,11H2.
What are the key properties of 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline?
8-(2,3-dihydro-1H-isoindol-1-yl)quinoline has a molecular weight of 246.31 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3-dihydro-1H-isoindol-1-yl)quinoline is sourced from PubChem (CID 81224395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).