7-methoxy-2,2-dimethyl-1,3-dihydroindole

Name: 7-methoxy-2,2-dimethyl-1,3-dihydroindole — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₁H₁₅NO — CID 84717961

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC7-methoxy-2,2-dimethyl-1,3-dihydroindole

SMILESCOc1cccc2c1NC(C)(C)C2

InChIInChI=1S/C11H15NO/c1-11(2)7-8-5-4-6-9(13-3)10(8)12-11/h4-6,12H,7H2,1-3H3

InChIKeyJGJOSKIVARDDCJ-UHFFFAOYSA-N

MW177.25 g/mol

LogP2.44

Rot. Bonds1

About 7-methoxy-2,2-dimethyl-1,3-dihydroindole

7-methoxy-2,2-dimethyl-1,3-dihydroindole (PubChem CID 84717961) has the molecular formula C₁₁H₁₅NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 7-methoxy-2,2-dimethyl-1,3-dihydroindole.

Molecular Properties

Compound Name	7-methoxy-2,2-dimethyl-1,3-dihydroindole
PubChem CID	84717961
Molecular Formula	C₁₁H₁₅NO
Molecular Weight	177.25 g/mol
Exact Mass	177.12
IUPAC Name	7-methoxy-2,2-dimethyl-1,3-dihydroindole
SMILES	COc1cccc2c1NC(C)(C)C2
InChI	InChI=1S/C11H15NO/c1-11(2)7-8-5-4-6-9(13-3)10(8)12-11/h4-6,12H,7H2,1-3H3
InChIKey	JGJOSKIVARDDCJ-UHFFFAOYSA-N
XLogP	2.44
TPSA	21.26 Å²
H-Bond Donors	1
H-Bond Acceptors	2
Rotatable Bonds	1
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	177.25
LogP ≤ 5	2.44
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,2-dimethyl-1,3-dihydroindole?

The IUPAC name of 7-methoxy-2,2-dimethyl-1,3-dihydroindole (CID 84717961) is 7-methoxy-2,2-dimethyl-1,3-dihydroindole.

What is the SMILES notation for 7-methoxy-2,2-dimethyl-1,3-dihydroindole?

The canonical SMILES for 7-methoxy-2,2-dimethyl-1,3-dihydroindole is COc1cccc2c1NC(C)(C)C2.

What is the InChIKey of 7-methoxy-2,2-dimethyl-1,3-dihydroindole?

The InChIKey is JGJOSKIVARDDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-11(2)7-8-5-4-6-9(13-3)10(8)12-11/h4-6,12H,7H2,1-3H3.

What are the key properties of 7-methoxy-2,2-dimethyl-1,3-dihydroindole?

7-methoxy-2,2-dimethyl-1,3-dihydroindole has a molecular weight of 177.25 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-methoxy-2,2-dimethyl-1,3-dihydroindole is sourced from PubChem (CID 84717961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 84717961 — identifiers, structure, computed properties (public domain)

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