7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine

C11H15NO — CID 68632948

IUPAC7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCOc1cc(C)cc2c1C(N)CC2
InChIInChI=1S/C11H15NO/c1-7-5-8-3-4-9(12)11(8)10(6-7)13-2/h5-6,9H,3-4,12H2,1-2H3
InChIKeyGBJVXZVICWZEQX-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.95
Rot. Bonds1

About 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine

7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 68632948) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID68632948
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCOc1cc(C)cc2c1C(N)CC2
InChIInChI=1S/C11H15NO/c1-7-5-8-3-4-9(12)11(8)10(6-7)13-2/h5-6,9H,3-4,12H2,1-2H3
InChIKeyGBJVXZVICWZEQX-UHFFFAOYSA-N
XLogP1.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine (CID 68632948) is 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine is COc1cc(C)cc2c1C(N)CC2.
What is the InChIKey of 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GBJVXZVICWZEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-7-5-8-3-4-9(12)11(8)10(6-7)13-2/h5-6,9H,3-4,12H2,1-2H3.
What are the key properties of 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine?
7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 177.25 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 68632948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).