1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine

C13H18N2O — CID 83860032

IUPAC1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine
SMILESCNC(C)c1cn(C)c2c(OC)cccc12
InChIInChI=1S/C13H18N2O/c1-9(14-2)11-8-15(3)13-10(11)6-5-7-12(13)16-4/h5-9,14H,1-4H3
InChIKeyXWQVHAXOMYTYSE-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.47
Rot. Bonds3

About 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine

1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine (PubChem CID 83860032) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine
PubChem CID83860032
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine
SMILESCNC(C)c1cn(C)c2c(OC)cccc12
InChIInChI=1S/C13H18N2O/c1-9(14-2)11-8-15(3)13-10(11)6-5-7-12(13)16-4/h5-9,14H,1-4H3
InChIKeyXWQVHAXOMYTYSE-UHFFFAOYSA-N
XLogP2.47
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-bromo-1-methylindol-3-yl)-N-methylethanamine
CID 117197621
2-(7-methoxy-1-methylindol-3-yl)-3-methylbutanoic acid
CID 82666117
1-(7-methoxy-1-methylindol-3-yl)-N-methylmethanamine
CID 22139134
1-(6-chloro-1,7-dimethylindol-3-yl)-N-methylethanamine
CID 83868417
1-(7-methoxy-1-methylindol-2-yl)-N-methylethanamine
CID 83859915
3-[1-(methylamino)ethyl]-1-propan-2-ylindol-7-ol
CID 117197935
1-(4-methoxy-1-propan-2-ylindol-3-yl)-N-methylethanamine
CID 117195040
1-(1-ethyl-7-methoxyindol-3-yl)-N-methylpropan-2-amine
CID 117197951
8-methoxy-2-methyl-4-propan-2-ylisoquinolin-1-one
CID 115063489
1-(7-methoxy-2-methyl-1H-indol-3-yl)-N-methylethanamine
CID 65333048
5-methoxy-2-methyl-4-propan-2-ylisoquinolin-1-one
CID 115063414
methyl 3-(7-methoxy-1-methylindol-3-yl)-3-oxopropanoate
CID 82666025

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine?
The IUPAC name of 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine (CID 83860032) is 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine.
What is the SMILES notation for 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine?
The canonical SMILES for 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine is CNC(C)c1cn(C)c2c(OC)cccc12.
What is the InChIKey of 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine?
The InChIKey is XWQVHAXOMYTYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9(14-2)11-8-15(3)13-10(11)6-5-7-12(13)16-4/h5-9,14H,1-4H3.
What are the key properties of 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine?
1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine has a molecular weight of 218.30 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine is sourced from PubChem (CID 83860032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).