2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine

C12H18N2 — CID 11074217

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1CNc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(2)8-7-10-9-13-12-6-4-3-5-11(10)12/h3-6,10,13H,7-9H2,1-2H3
InChIKeyQJONJVMVPXLFKY-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.15
Rot. Bonds3

About 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine

2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine (PubChem CID 11074217) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine
PubChem CID11074217
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1CNc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(2)8-7-10-9-13-12-6-4-3-5-11(10)12/h3-6,10,13H,7-9H2,1-2H3
InChIKeyQJONJVMVPXLFKY-UHFFFAOYSA-N
XLogP2.15
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine (CID 11074217) is 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine is CN(C)CCC1CNc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine?
The InChIKey is QJONJVMVPXLFKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-14(2)8-7-10-9-13-12-6-4-3-5-11(10)12/h3-6,10,13H,7-9H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine?
2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 11074217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).