1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine

C11H15BrN2 — CID 82380805

IUPAC1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1cc2c(cc1Br)NCC2
InChIInChI=1S/C11H15BrN2/c1-14(2)7-9-5-8-3-4-13-11(8)6-10(9)12/h5-6,13H,3-4,7H2,1-2H3
InChIKeyDBPXGLJVSVBKLX-UHFFFAOYSA-N
MW255.16 g/mol
LogP2.48
Rot. Bonds2

About 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine

1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine (PubChem CID 82380805) has the molecular formula C11H15BrN2 and a molecular weight of 255.16 g/mol. Its IUPAC name is 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine
PubChem CID82380805
Molecular FormulaC11H15BrN2
Molecular Weight255.16 g/mol
Exact Mass254.04
IUPAC Name1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1cc2c(cc1Br)NCC2
InChIInChI=1S/C11H15BrN2/c1-14(2)7-9-5-8-3-4-13-11(8)6-10(9)12/h5-6,13H,3-4,7H2,1-2H3
InChIKeyDBPXGLJVSVBKLX-UHFFFAOYSA-N
XLogP2.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.16
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine (CID 82380805) is 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine is CN(C)Cc1cc2c(cc1Br)NCC2.
What is the InChIKey of 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine?
The InChIKey is DBPXGLJVSVBKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2/c1-14(2)7-9-5-8-3-4-13-11(8)6-10(9)12/h5-6,13H,3-4,7H2,1-2H3.
What are the key properties of 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine?
1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine has a molecular weight of 255.16 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-2,3-dihydro-1H-indol-5-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 82380805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).