2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline

C19H18N2O — CID 4317391

IUPAC2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline
SMILESCOc1ccc2c(c1)CCNC2c1ccc2ccccc2n1
InChIInChI=1S/C19H18N2O/c1-22-15-7-8-16-14(12-15)10-11-20-19(16)18-9-6-13-4-2-3-5-17(13)21-18/h2-9,12,19-20H,10-11H2,1H3
InChIKeyMFNKSZZFQPCLMY-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.48
Rot. Bonds2

About 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline

2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline (PubChem CID 4317391) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline.

Molecular Properties

Compound Name2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline
PubChem CID4317391
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline
SMILESCOc1ccc2c(c1)CCNC2c1ccc2ccccc2n1
InChIInChI=1S/C19H18N2O/c1-22-15-7-8-16-14(12-15)10-11-20-19(16)18-9-6-13-4-2-3-5-17(13)21-18/h2-9,12,19-20H,10-11H2,1H3
InChIKeyMFNKSZZFQPCLMY-UHFFFAOYSA-N
XLogP3.48
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-quinolin-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol
CID 4000176
2-(7-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline
CID 3274019
6-methoxy-1-naphthalen-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 4019885
2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline
CID 4040394
6-methoxy-1-quinolin-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
CID 4021262
6-methoxy-1-(5-methyl-2-pyridinyl)-1,2,3,4-tetrahydroisoquinoline
CID 3471481
6-methoxy-1-(2,3,4-trifluorophenyl)-1,2,3,4-tetrahydroisoquinoline
CID 106543754
6-methoxy-1-(2-methoxy-5-phenylphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 3623232
6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-ol;hydrochloride
CID 90423697
(1S)-1-(3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 7010656
6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile
CID 102340504
6-methoxy-1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 143954648

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline?
The IUPAC name of 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline (CID 4317391) is 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline.
What is the SMILES notation for 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline?
The canonical SMILES for 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline is COc1ccc2c(c1)CCNC2c1ccc2ccccc2n1.
What is the InChIKey of 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline?
The InChIKey is MFNKSZZFQPCLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-22-15-7-8-16-14(12-15)10-11-20-19(16)18-9-6-13-4-2-3-5-17(13)21-18/h2-9,12,19-20H,10-11H2,1H3.
What are the key properties of 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline?
2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline has a molecular weight of 290.37 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)quinoline is sourced from PubChem (CID 4317391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).