2-(2-methyl-7H-indol-3-yl)ethanamine

C11H14N2 — CID 67231108

IUPAC2-(2-methyl-7H-indol-3-yl)ethanamine
SMILESCC1=C(CCN)C2=CC=CCC2=N1
InChIInChI=1S/C11H14N2/c1-8-9(6-7-12)10-4-2-3-5-11(10)13-8/h2-4H,5-7,12H2,1H3
InChIKeyGHWYKJABQNZJQW-UHFFFAOYSA-N
MW174.25 g/mol
LogP1.95
Rot. Bonds2

About 2-(2-methyl-7H-indol-3-yl)ethanamine

2-(2-methyl-7H-indol-3-yl)ethanamine (PubChem CID 67231108) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2-(2-methyl-7H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2-methyl-7H-indol-3-yl)ethanamine
PubChem CID67231108
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2-(2-methyl-7H-indol-3-yl)ethanamine
SMILESCC1=C(CCN)C2=CC=CCC2=N1
InChIInChI=1S/C11H14N2/c1-8-9(6-7-12)10-4-2-3-5-11(10)13-8/h2-4H,5-7,12H2,1H3
InChIKeyGHWYKJABQNZJQW-UHFFFAOYSA-N
XLogP1.95
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-7H-indol-3-yl)ethanamine?
The IUPAC name of 2-(2-methyl-7H-indol-3-yl)ethanamine (CID 67231108) is 2-(2-methyl-7H-indol-3-yl)ethanamine.
What is the SMILES notation for 2-(2-methyl-7H-indol-3-yl)ethanamine?
The canonical SMILES for 2-(2-methyl-7H-indol-3-yl)ethanamine is CC1=C(CCN)C2=CC=CCC2=N1.
What is the InChIKey of 2-(2-methyl-7H-indol-3-yl)ethanamine?
The InChIKey is GHWYKJABQNZJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8-9(6-7-12)10-4-2-3-5-11(10)13-8/h2-4H,5-7,12H2,1H3.
What are the key properties of 2-(2-methyl-7H-indol-3-yl)ethanamine?
2-(2-methyl-7H-indol-3-yl)ethanamine has a molecular weight of 174.25 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-7H-indol-3-yl)ethanamine is sourced from PubChem (CID 67231108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).