1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline

C20H24N2 — CID 129289153

IUPAC1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline
SMILESCN1CCc2cc(C3Cc4ccccc4N(C)C3)ccc2C1
InChIInChI=1S/C20H24N2/c1-21-10-9-16-11-15(7-8-18(16)13-21)19-12-17-5-3-4-6-20(17)22(2)14-19/h3-8,11,19H,9-10,12-14H2,1-2H3
InChIKeyUJQRISMXJCQKOB-UHFFFAOYSA-N
MW292.43 g/mol
LogP3.45
Rot. Bonds1

About 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline

1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline (PubChem CID 129289153) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline
PubChem CID129289153
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline
SMILESCN1CCc2cc(C3Cc4ccccc4N(C)C3)ccc2C1
InChIInChI=1S/C20H24N2/c1-21-10-9-16-11-15(7-8-18(16)13-21)19-12-17-5-3-4-6-20(17)22(2)14-19/h3-8,11,19H,9-10,12-14H2,1-2H3
InChIKeyUJQRISMXJCQKOB-UHFFFAOYSA-N
XLogP3.45
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline?
The IUPAC name of 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline (CID 129289153) is 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline?
The canonical SMILES for 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline is CN1CCc2cc(C3Cc4ccccc4N(C)C3)ccc2C1.
What is the InChIKey of 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline?
The InChIKey is UJQRISMXJCQKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2/c1-21-10-9-16-11-15(7-8-18(16)13-21)19-12-17-5-3-4-6-20(17)22(2)14-19/h3-8,11,19H,9-10,12-14H2,1-2H3.
What are the key properties of 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline?
1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline has a molecular weight of 292.43 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 129289153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).