1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine

C11H13BrN2 — CID 83900734

IUPAC1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine
SMILESCNCc1ccc2c(Br)cn(C)c2c1
InChIInChI=1S/C11H13BrN2/c1-13-6-8-3-4-9-10(12)7-14(2)11(9)5-8/h3-5,7,13H,6H2,1-2H3
InChIKeyNMIGCEPPNGDQMT-UHFFFAOYSA-N
MW253.14 g/mol
LogP2.66
Rot. Bonds2

About 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine

1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine (PubChem CID 83900734) has the molecular formula C11H13BrN2 and a molecular weight of 253.14 g/mol. Its IUPAC name is 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine
PubChem CID83900734
Molecular FormulaC11H13BrN2
Molecular Weight253.14 g/mol
Exact Mass252.03
IUPAC Name1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine
SMILESCNCc1ccc2c(Br)cn(C)c2c1
InChIInChI=1S/C11H13BrN2/c1-13-6-8-3-4-9-10(12)7-14(2)11(9)5-8/h3-5,7,13H,6H2,1-2H3
InChIKeyNMIGCEPPNGDQMT-UHFFFAOYSA-N
XLogP2.66
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.14
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-1-methylindol-6-yl)acetaldehyde
CID 83900513
2-(3-bromo-1-methylindol-5-yl)-N-methylethanamine
CID 83902666
3-bromo-1-methyl-6-(pyrrolidin-2-ylmethyl)indole
CID 117473095
3-bromo-N,1-dimethylindole-6-carboxamide
CID 170838828
1-(3-bromo-1,2-dimethylindol-5-yl)-N-methylmethanamine
CID 84711896
2-(1,3-dimethylindol-6-yl)-N-methylethanamine
CID 117205026
1-(3-bromo-4-chlorophenyl)-N-methylmethanamine
CID 75355471
1-(6-chloro-1-methylindol-3-yl)-N-methylmethanamine
CID 22139039
1-[4-(3-bromoindol-1-yl)sulfonylphenyl]-N-methylmethanamine
CID 54220929
N-methyl-1-(1-methylindazol-5-yl)methanamine
CID 82598913
1-(1,3-dimethylindol-6-yl)-N-methylpropan-2-amine
CID 117205030
1-[9-(2-bromoethyl)carbazol-3-yl]-N-methylmethanamine
CID 58181084

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine (CID 83900734) is 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine is CNCc1ccc2c(Br)cn(C)c2c1.
What is the InChIKey of 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine?
The InChIKey is NMIGCEPPNGDQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2/c1-13-6-8-3-4-9-10(12)7-14(2)11(9)5-8/h3-5,7,13H,6H2,1-2H3.
What are the key properties of 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine?
1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine has a molecular weight of 253.14 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-1-methylindol-6-yl)-N-methylmethanamine is sourced from PubChem (CID 83900734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).