N-ethyl-2-(7-ethylindol-1-yl)ethanamine

C14H20N2 — CID 62562665

IUPACN-ethyl-2-(7-ethylindol-1-yl)ethanamine
SMILESCCNCCn1ccc2cccc(CC)c21
InChIInChI=1S/C14H20N2/c1-3-12-6-5-7-13-8-10-16(14(12)13)11-9-15-4-2/h5-8,10,15H,3-4,9,11H2,1-2H3
InChIKeyOMRQJMPNPKQDQZ-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.81
Rot. Bonds5

About N-ethyl-2-(7-ethylindol-1-yl)ethanamine

N-ethyl-2-(7-ethylindol-1-yl)ethanamine (PubChem CID 62562665) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-ethyl-2-(7-ethylindol-1-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(7-ethylindol-1-yl)ethanamine
PubChem CID62562665
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-ethyl-2-(7-ethylindol-1-yl)ethanamine
SMILESCCNCCn1ccc2cccc(CC)c21
InChIInChI=1S/C14H20N2/c1-3-12-6-5-7-13-8-10-16(14(12)13)11-9-15-4-2/h5-8,10,15H,3-4,9,11H2,1-2H3
InChIKeyOMRQJMPNPKQDQZ-UHFFFAOYSA-N
XLogP2.81
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(7-chloroindol-1-yl)-N-ethylethanamine
CID 103474607
2-(7-ethylindol-1-yl)-N-[(5-methylthiophen-2-yl)methyl]ethanamine
CID 63502619
N-[2-(7-ethylindol-1-yl)ethyl]-1-thiophen-2-ylethanamine
CID 63504332
7-ethyl-1-(2-piperidin-1-ylethyl)indole
CID 116618924
N-[[1-(2-ethylsulfonylethyl)indol-7-yl]methyl]ethanamine
CID 102914060
4-(7-ethylindol-1-yl)-N-propan-2-ylbutan-1-amine
CID 62563359
7-ethyl-1-(2-propoxyethyl)indole
CID 106458036
N-[2-(7-ethylindol-1-yl)ethyl]heptan-2-amine
CID 63504333
7-ethyl-1-(3-methylsulfanylpropyl)indole
CID 116618726
5-[7-(ethylaminomethyl)indol-1-yl]pentan-1-ol
CID 102914086
1-(2-tert-butylsulfonylethyl)-7-ethylindole
CID 106731619
N-[[1-(2-piperidin-1-ylethyl)indol-7-yl]methyl]ethanamine
CID 102914153

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(7-ethylindol-1-yl)ethanamine?
The IUPAC name of N-ethyl-2-(7-ethylindol-1-yl)ethanamine (CID 62562665) is N-ethyl-2-(7-ethylindol-1-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(7-ethylindol-1-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(7-ethylindol-1-yl)ethanamine is CCNCCn1ccc2cccc(CC)c21.
What is the InChIKey of N-ethyl-2-(7-ethylindol-1-yl)ethanamine?
The InChIKey is OMRQJMPNPKQDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-3-12-6-5-7-13-8-10-16(14(12)13)11-9-15-4-2/h5-8,10,15H,3-4,9,11H2,1-2H3.
What are the key properties of N-ethyl-2-(7-ethylindol-1-yl)ethanamine?
N-ethyl-2-(7-ethylindol-1-yl)ethanamine has a molecular weight of 216.33 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(7-ethylindol-1-yl)ethanamine is sourced from PubChem (CID 62562665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).