7-methoxy-2,3-dihydro-1H-indole

C9H11NO — CID 14849554

IUPAC7-methoxy-2,3-dihydro-1H-indole
SMILESCOc1cccc2c1NCC2
InChIInChI=1S/C9H11NO/c1-11-8-4-2-3-7-5-6-10-9(7)8/h2-4,10H,5-6H2,1H3
InChIKeyQLVATPFLTCNUBR-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.66
Rot. Bonds1

About 7-methoxy-2,3-dihydro-1H-indole

7-methoxy-2,3-dihydro-1H-indole (PubChem CID 14849554) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 7-methoxy-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name7-methoxy-2,3-dihydro-1H-indole
PubChem CID14849554
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name7-methoxy-2,3-dihydro-1H-indole
SMILESCOc1cccc2c1NCC2
InChIInChI=1S/C9H11NO/c1-11-8-4-2-3-7-5-6-10-9(7)8/h2-4,10H,5-6H2,1H3
InChIKeyQLVATPFLTCNUBR-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-methoxy-2,3-dihydro-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,3-dihydro-1H-indole?
The IUPAC name of 7-methoxy-2,3-dihydro-1H-indole (CID 14849554) is 7-methoxy-2,3-dihydro-1H-indole.
What is the SMILES notation for 7-methoxy-2,3-dihydro-1H-indole?
The canonical SMILES for 7-methoxy-2,3-dihydro-1H-indole is COc1cccc2c1NCC2.
What is the InChIKey of 7-methoxy-2,3-dihydro-1H-indole?
The InChIKey is QLVATPFLTCNUBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-11-8-4-2-3-7-5-6-10-9(7)8/h2-4,10H,5-6H2,1H3.
What are the key properties of 7-methoxy-2,3-dihydro-1H-indole?
7-methoxy-2,3-dihydro-1H-indole has a molecular weight of 149.19 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2,3-dihydro-1H-indole is sourced from PubChem (CID 14849554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).