6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline

C13H17NO2 — CID 11063933

IUPAC6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline
SMILESC=C1c2cc(OC)c(OC)cc2CCN1C
InChIInChI=1S/C13H17NO2/c1-9-11-8-13(16-4)12(15-3)7-10(11)5-6-14(9)2/h7-8H,1,5-6H2,2-4H3
InChIKeyUMJQMMDWIKGWOQ-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.16
Rot. Bonds2

About 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline

6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline (PubChem CID 11063933) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline.

Molecular Properties

Compound Name6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline
PubChem CID11063933
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline
SMILESC=C1c2cc(OC)c(OC)cc2CCN1C
InChIInChI=1S/C13H17NO2/c1-9-11-8-13(16-4)12(15-3)7-10(11)5-6-14(9)2/h7-8H,1,5-6H2,2-4H3
InChIKeyUMJQMMDWIKGWOQ-UHFFFAOYSA-N
XLogP2.16
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)propan-1-one
CID 14845147
2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene
CID 848565
7,8-dimethoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride
CID 23462892
N-hexyl-6,7-dimethoxy-2-methyl-3,4-dihydroisoquinolin-1-imine
CID 3651775
(6-bromo-2,3-dimethoxyphenyl)-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)methanone
CID 10917323
6,7-dimethoxy-1-methyl-2,3-dihydroquinolin-4-one
CID 82276318
2-(3-chloropropyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-1-one
CID 13327027
(E)-3-(3-chlorophenyl)-1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)prop-2-en-1-one
CID 6227120
8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine
CID 12748079
7-methoxy-3,8-dimethyl-2,5-dihydro-1H-3-benzazepin-4-one
CID 22400696
6,7-dimethoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinoline
CID 22646
1-bromo-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
CID 116995533

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline?
The IUPAC name of 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline (CID 11063933) is 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline.
What is the SMILES notation for 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline?
The canonical SMILES for 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline is C=C1c2cc(OC)c(OC)cc2CCN1C.
What is the InChIKey of 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline?
The InChIKey is UMJQMMDWIKGWOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-9-11-8-13(16-4)12(15-3)7-10(11)5-6-14(9)2/h7-8H,1,5-6H2,2-4H3.
What are the key properties of 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline?
6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline has a molecular weight of 219.28 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-2-methyl-1-methylidene-3,4-dihydroisoquinoline is sourced from PubChem (CID 11063933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).