7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine

C17H19NO2 — CID 23031095

IUPAC7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine
SMILESCOc1ccc(Oc2c(C)cc(N)c3c2CCC3)cc1
InChIInChI=1S/C17H19NO2/c1-11-10-16(18)14-4-3-5-15(14)17(11)20-13-8-6-12(19-2)7-9-13/h6-10H,3-5,18H2,1-2H3
InChIKeyGCLVAYMCQLVYMG-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.87
Rot. Bonds3

About 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine

7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine (PubChem CID 23031095) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine.

Molecular Properties

Compound Name7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine
PubChem CID23031095
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine
SMILESCOc1ccc(Oc2c(C)cc(N)c3c2CCC3)cc1
InChIInChI=1S/C17H19NO2/c1-11-10-16(18)14-4-3-5-15(14)17(11)20-13-8-6-12(19-2)7-9-13/h6-10H,3-5,18H2,1-2H3
InChIKeyGCLVAYMCQLVYMG-UHFFFAOYSA-N
XLogP3.87
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine 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-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine?
The IUPAC name of 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine (CID 23031095) is 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine.
What is the SMILES notation for 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine?
The canonical SMILES for 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine is COc1ccc(Oc2c(C)cc(N)c3c2CCC3)cc1.
What is the InChIKey of 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine?
The InChIKey is GCLVAYMCQLVYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-11-10-16(18)14-4-3-5-15(14)17(11)20-13-8-6-12(19-2)7-9-13/h6-10H,3-5,18H2,1-2H3.
What are the key properties of 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine?
7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine has a molecular weight of 269.34 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methoxyphenoxy)-6-methyl-2,3-dihydro-1H-inden-4-amine is sourced from PubChem (CID 23031095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).