5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole

C20H23NO4 — CID 10065905

IUPAC5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole
SMILESCOCOc1c(OC)ccc2c1c(C)c(-c1ccccc1OC)n2C
InChIInChI=1S/C20H23NO4/c1-13-18-15(10-11-17(24-5)20(18)25-12-22-3)21(2)19(13)14-8-6-7-9-16(14)23-4/h6-11H,12H2,1-5H3
InChIKeyYYFKHFNEHKNRIV-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.15
Rot. Bonds6

About 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole

5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole (PubChem CID 10065905) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole.

Molecular Properties

Compound Name5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole
PubChem CID10065905
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC Name5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole
SMILESCOCOc1c(OC)ccc2c1c(C)c(-c1ccccc1OC)n2C
InChIInChI=1S/C20H23NO4/c1-13-18-15(10-11-17(24-5)20(18)25-12-22-3)21(2)19(13)14-8-6-7-9-16(14)23-4/h6-11H,12H2,1-5H3
InChIKeyYYFKHFNEHKNRIV-UHFFFAOYSA-N
XLogP4.15
TPSA41.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole-7-carbaldehyde
CID 10384461
(E)-3-[5-methoxy-4-(methoxymethoxy)-1,3-dimethyl-2-(2-methylphenyl)indol-7-yl]-2-methylprop-2-enoic acid
CID 10386793
ethyl (E)-3-[5-methoxy-4-(methoxymethoxy)-1,3-dimethyl-2-(2-methylphenyl)indol-7-yl]-2-methylprop-2-enoate
CID 10343027
1,3-dimethyl-2-(2-methylphenyl)benzo[e]indole
CID 144605644
1-(methoxymethoxy)-2,3,4,5,6-pentamethylbenzene;1-methoxy-2,3,4,5,6-pentamethylbenzene
CID 91426597
5-chloro-2-(2-methoxyphenyl)-1-methylimidazole
CID 117259261
3-(4-chlorophenyl)-2-(2-methoxyphenyl)-1-methylindole
CID 102421670
1,2-bis(methoxymethoxy)-3-phenylbenzene
CID 11000249
5-methoxy-1,3-dimethyl-6-(2-methylpropoxy)-2-phenylquinolin-4-one
CID 516424
9,10-bis(methoxymethoxy)anthracene
CID 150706504
3-methoxy-2-(methoxymethoxy)benzaldehyde
CID 11644081
4-(2-methoxyphenyl)-N,N,6-trimethyl-2H-pyrrolo[3,4-c]carbazol-9-amine
CID 91210328

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole?
The IUPAC name of 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole (CID 10065905) is 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole.
What is the SMILES notation for 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole?
The canonical SMILES for 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole is COCOc1c(OC)ccc2c1c(C)c(-c1ccccc1OC)n2C.
What is the InChIKey of 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole?
The InChIKey is YYFKHFNEHKNRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-13-18-15(10-11-17(24-5)20(18)25-12-22-3)21(2)19(13)14-8-6-7-9-16(14)23-4/h6-11H,12H2,1-5H3.
What are the key properties of 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole?
5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole has a molecular weight of 341.41 g/mol, XLogP of 4.15, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-(methoxymethoxy)-2-(2-methoxyphenyl)-1,3-dimethylindole is sourced from PubChem (CID 10065905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).