6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine

C13H19NO — CID 79726730

IUPAC6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1c2cc(OC)ccc2C(C)C1C
InChIInChI=1S/C13H19NO/c1-8-9(2)13(14-3)12-7-10(15-4)5-6-11(8)12/h5-9,13-14H,1-4H3
InChIKeyRUNGOANTZDUVCJ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.71
Rot. Bonds2

About 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine

6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 79726730) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine
PubChem CID79726730
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1c2cc(OC)ccc2C(C)C1C
InChIInChI=1S/C13H19NO/c1-8-9(2)13(14-3)12-7-10(15-4)5-6-11(8)12/h5-9,13-14H,1-4H3
InChIKeyRUNGOANTZDUVCJ-UHFFFAOYSA-N
XLogP2.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine (CID 79726730) is 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine is CNC1c2cc(OC)ccc2C(C)C1C.
What is the InChIKey of 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is RUNGOANTZDUVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-8-9(2)13(14-3)12-7-10(15-4)5-6-11(8)12/h5-9,13-14H,1-4H3.
What are the key properties of 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine?
6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,2,3-trimethyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 79726730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).