2-[1-(2-ethylbutyl)indol-3-yl]ethanamine

C16H24N2 — CID 82925282

IUPAC2-[1-(2-ethylbutyl)indol-3-yl]ethanamine
SMILESCCC(CC)Cn1cc(CCN)c2ccccc21
InChIInChI=1S/C16H24N2/c1-3-13(4-2)11-18-12-14(9-10-17)15-7-5-6-8-16(15)18/h5-8,12-13H,3-4,9-11,17H2,1-2H3
InChIKeyCIJQTPWBGXSCTD-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.58
Rot. Bonds6

About 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine

2-[1-(2-ethylbutyl)indol-3-yl]ethanamine (PubChem CID 82925282) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-ethylbutyl)indol-3-yl]ethanamine
PubChem CID82925282
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name2-[1-(2-ethylbutyl)indol-3-yl]ethanamine
SMILESCCC(CC)Cn1cc(CCN)c2ccccc21
InChIInChI=1S/C16H24N2/c1-3-13(4-2)11-18-12-14(9-10-17)15-7-5-6-8-16(15)18/h5-8,12-13H,3-4,9-11,17H2,1-2H3
InChIKeyCIJQTPWBGXSCTD-UHFFFAOYSA-N
XLogP3.58
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-prop-2-enylindol-3-yl)ethanamine
CID 10375539
2-[1-[2-(dimethylamino)ethyl]indol-3-yl]ethanamine
CID 10421424
2-(1-propan-2-ylindol-3-yl)ethanamine
CID 5115445
2-[1-(3-methylsulfanylpropyl)indol-3-yl]ethanamine
CID 113474367
2-[3-(2-aminoethyl)indol-1-yl]-N-ethyl-N-methylacetamide
CID 63156515
3-[3-(2-aminoethyl)indol-1-yl]propanamide
CID 55164863
2-[1-(3-phenylpropyl)indol-3-yl]ethanamine
CID 63156675
2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]indol-3-yl]ethanamine
CID 112591716
2-(1-chloroindol-3-yl)ethanamine
CID 22722065
2-(1-ethylsulfonylindol-3-yl)ethanamine
CID 82481545
2-[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-3-yl]ethanamine
CID 103015036
2-[1-[(1-methylpyrazol-3-yl)methyl]indol-3-yl]ethanamine
CID 82871680

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine?
The IUPAC name of 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine (CID 82925282) is 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine?
The canonical SMILES for 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine is CCC(CC)Cn1cc(CCN)c2ccccc21.
What is the InChIKey of 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine?
The InChIKey is CIJQTPWBGXSCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-3-13(4-2)11-18-12-14(9-10-17)15-7-5-6-8-16(15)18/h5-8,12-13H,3-4,9-11,17H2,1-2H3.
What are the key properties of 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine?
2-[1-(2-ethylbutyl)indol-3-yl]ethanamine has a molecular weight of 244.38 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethylbutyl)indol-3-yl]ethanamine is sourced from PubChem (CID 82925282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).