5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline

C16H17NO2 — CID 14092061

IUPAC5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline
SMILESCOc1c2c(c(OC)c3ccccc13)C(C)=NCC2
InChIInChI=1S/C16H17NO2/c1-10-14-13(8-9-17-10)15(18-2)11-6-4-5-7-12(11)16(14)19-3/h4-7H,8-9H2,1-3H3
InChIKeyDIJDEBDDUUMBSE-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.22
Rot. Bonds2

About 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline

5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline (PubChem CID 14092061) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline.

Molecular Properties

Compound Name5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline
PubChem CID14092061
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline
SMILESCOc1c2c(c(OC)c3ccccc13)C(C)=NCC2
InChIInChI=1S/C16H17NO2/c1-10-14-13(8-9-17-10)15(18-2)11-6-4-5-7-12(11)16(14)19-3/h4-7H,8-9H2,1-3H3
InChIKeyDIJDEBDDUUMBSE-UHFFFAOYSA-N
XLogP3.22
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;hydrochloride
CID 135534458
1-ethyl-5-methoxy-6-phenylmethoxy-3,4-dihydroisoquinoline
CID 122650537
5-butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline
CID 3754904
methyl 1-hydroxy-7,12-dimethoxy-3-methyl-5,6-dihydrobenzo[a]anthracene-2-carboxylate
CID 11025259
10-methoxy-9-methyl-1,2,3,4-tetrahydrophenanthrene
CID 71499800
(2Z)-2-(4,9-dimethoxy-1H-benzo[f][2]benzofuran-3-ylidene)acetic acid
CID 95931289
9,10-dimethoxy-2-methylanthracene-1,4-dione
CID 14283285
9,10-dimethoxy-2-pentyl-1,2,3,4-tetrahydroanthracene
CID 153323217
9-bromo-10-(10-methoxyanthracen-9-yl)anthracene
CID 141476648
4,9-dimethoxybenzo[f][1,3]benzodioxole
CID 12558262
1-(4-methylphenyl)-4,9-dihydro-3H-pyrido[3,4-b]indole
CID 132837986
3,10,21-trimethoxy-14-methyl-12-thiapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 118099456

Frequently Asked Questions

What is the IUPAC name of 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline?
The IUPAC name of 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline (CID 14092061) is 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline.
What is the SMILES notation for 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline?
The canonical SMILES for 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline is COc1c2c(c(OC)c3ccccc13)C(C)=NCC2.
What is the InChIKey of 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline?
The InChIKey is DIJDEBDDUUMBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-10-14-13(8-9-17-10)15(18-2)11-6-4-5-7-12(11)16(14)19-3/h4-7H,8-9H2,1-3H3.
What are the key properties of 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline?
5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline has a molecular weight of 255.32 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dimethoxy-1-methyl-3,4-dihydrobenzo[g]isoquinoline is sourced from PubChem (CID 14092061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).