6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole

C11H15NO2 — CID 105447156

IUPAC6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole
SMILESCOc1cc(C)c2c(c1OC)NCC2
InChIInChI=1S/C11H15NO2/c1-7-6-9(13-2)11(14-3)10-8(7)4-5-12-10/h6,12H,4-5H2,1-3H3
InChIKeyZQWACACBWCYYQP-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.98
Rot. Bonds2

About 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole

6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole (PubChem CID 105447156) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole
PubChem CID105447156
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole
SMILESCOc1cc(C)c2c(c1OC)NCC2
InChIInChI=1S/C11H15NO2/c1-7-6-9(13-2)11(14-3)10-8(7)4-5-12-10/h6,12H,4-5H2,1-3H3
InChIKeyZQWACACBWCYYQP-UHFFFAOYSA-N
XLogP1.98
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole?
The IUPAC name of 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole (CID 105447156) is 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole.
What is the SMILES notation for 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole?
The canonical SMILES for 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole is COc1cc(C)c2c(c1OC)NCC2.
What is the InChIKey of 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole?
The InChIKey is ZQWACACBWCYYQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-7-6-9(13-2)11(14-3)10-8(7)4-5-12-10/h6,12H,4-5H2,1-3H3.
What are the key properties of 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole?
6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole has a molecular weight of 193.25 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-4-methyl-2,3-dihydro-1H-indole is sourced from PubChem (CID 105447156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).