2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine

C14H21NO — CID 105474790

IUPAC2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)(C)C1CCc2cccc(OC)c21
InChIInChI=1S/C14H21NO/c1-14(2,15-3)11-9-8-10-6-5-7-12(16-4)13(10)11/h5-7,11,15H,8-9H2,1-4H3
InChIKeyIZLQBAKXNYYRLB-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.72
Rot. Bonds3

About 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine

2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine (PubChem CID 105474790) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
PubChem CID105474790
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)(C)C1CCc2cccc(OC)c21
InChIInChI=1S/C14H21NO/c1-14(2,15-3)11-9-8-10-6-5-7-12(16-4)13(10)11/h5-7,11,15H,8-9H2,1-4H3
InChIKeyIZLQBAKXNYYRLB-UHFFFAOYSA-N
XLogP2.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The IUPAC name of 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine (CID 105474790) is 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The canonical SMILES for 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine is CNC(C)(C)C1CCc2cccc(OC)c21.
What is the InChIKey of 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
The InChIKey is IZLQBAKXNYYRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-14(2,15-3)11-9-8-10-6-5-7-12(16-4)13(10)11/h5-7,11,15H,8-9H2,1-4H3.
What are the key properties of 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine?
2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 105474790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).