2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine

C14H20N2 — CID 10775128

IUPAC2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine
SMILESCCc1ccc2[nH]cc(CCN(C)C)c2c1
InChIInChI=1S/C14H20N2/c1-4-11-5-6-14-13(9-11)12(10-15-14)7-8-16(2)3/h5-6,9-10,15H,4,7-8H2,1-3H3
InChIKeyZEHXYLDGQMEYAX-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.83
Rot. Bonds4

About 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine

2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine (PubChem CID 10775128) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine
PubChem CID10775128
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine
SMILESCCc1ccc2[nH]cc(CCN(C)C)c2c1
InChIInChI=1S/C14H20N2/c1-4-11-5-6-14-13(9-11)12(10-15-14)7-8-16(2)3/h5-6,9-10,15H,4,7-8H2,1-3H3
InChIKeyZEHXYLDGQMEYAX-UHFFFAOYSA-N
XLogP2.83
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Indole
CID 798
Skatole
CID 6736
Tryptamine
CID 1150
Sumatriptan
CID 5358
N,N-Dimethyltryptamine
CID 6089
Lysergic acid amide
CID 442072
Almotriptan
CID 123606
3,3'-Diindolylmethane
CID 3071
Gramine
CID 6890
Beta-Carboline
CID 64961
(+-)-alpha-Methyltryptamine
CID 9287
Naratriptan
CID 4440

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine (CID 10775128) is 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine is CCc1ccc2[nH]cc(CCN(C)C)c2c1.
What is the InChIKey of 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine?
The InChIKey is ZEHXYLDGQMEYAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-4-11-5-6-14-13(9-11)12(10-15-14)7-8-16(2)3/h5-6,9-10,15H,4,7-8H2,1-3H3.
What are the key properties of 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine?
2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine has a molecular weight of 216.33 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-1H-indol-3-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 10775128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).