2-(5,7-dimethoxyindol-1-yl)ethanamine

C12H16N2O2 — CID 82494071

IUPAC2-(5,7-dimethoxyindol-1-yl)ethanamine
SMILESCOc1cc(OC)c2c(ccn2CCN)c1
InChIInChI=1S/C12H16N2O2/c1-15-10-7-9-3-5-14(6-4-13)12(9)11(8-10)16-2/h3,5,7-8H,4,6,13H2,1-2H3
InChIKeyGAONEYPPOXJUKS-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.62
Rot. Bonds4

About 2-(5,7-dimethoxyindol-1-yl)ethanamine

2-(5,7-dimethoxyindol-1-yl)ethanamine (PubChem CID 82494071) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-(5,7-dimethoxyindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(5,7-dimethoxyindol-1-yl)ethanamine
PubChem CID82494071
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-(5,7-dimethoxyindol-1-yl)ethanamine
SMILESCOc1cc(OC)c2c(ccn2CCN)c1
InChIInChI=1S/C12H16N2O2/c1-15-10-7-9-3-5-14(6-4-13)12(9)11(8-10)16-2/h3,5,7-8H,4,6,13H2,1-2H3
InChIKeyGAONEYPPOXJUKS-UHFFFAOYSA-N
XLogP1.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5,7-dimethoxyindol-1-yl)butan-1-amine
CID 83968623
5,7-dimethoxyindol-1-amine
CID 96624254
2-(5,7-dimethylindol-1-yl)ethanamine
CID 82490847
2-(5,7-dimethoxy-2,3-dimethylindol-1-yl)ethanamine
CID 82498803
2-(5-chloro-7-methylindol-1-yl)ethanamine
CID 130281365
2-(5-propoxyindol-1-yl)ethanamine
CID 80643088
3-(5-methoxyindol-1-yl)propanamide
CID 116619447
2-(5-methylindol-1-yl)ethanamine;hydrochloride
CID 91640635
3-(5,7-dimethoxyindol-1-yl)-N,N-dimethylcyclobutan-1-amine
CID 162388725
2-(5,7-dimethoxy-1-methylindol-6-yl)ethanamine
CID 96590371
3-(5,7-dimethylindol-1-yl)propan-1-amine
CID 82491687
1-(2-aminoethyl)-7-tert-butylindole-5-carboxylic acid
CID 83945646

Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dimethoxyindol-1-yl)ethanamine?
The IUPAC name of 2-(5,7-dimethoxyindol-1-yl)ethanamine (CID 82494071) is 2-(5,7-dimethoxyindol-1-yl)ethanamine.
What is the SMILES notation for 2-(5,7-dimethoxyindol-1-yl)ethanamine?
The canonical SMILES for 2-(5,7-dimethoxyindol-1-yl)ethanamine is COc1cc(OC)c2c(ccn2CCN)c1.
What is the InChIKey of 2-(5,7-dimethoxyindol-1-yl)ethanamine?
The InChIKey is GAONEYPPOXJUKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-15-10-7-9-3-5-14(6-4-13)12(9)11(8-10)16-2/h3,5,7-8H,4,6,13H2,1-2H3.
What are the key properties of 2-(5,7-dimethoxyindol-1-yl)ethanamine?
2-(5,7-dimethoxyindol-1-yl)ethanamine has a molecular weight of 220.27 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dimethoxyindol-1-yl)ethanamine is sourced from PubChem (CID 82494071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).