2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide

C19H28N2O — CID 17271853

IUPAC2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide
SMILESCCCCC(CC)C(=O)NCCc1c[nH]c2ccc(C)cc12
InChIInChI=1S/C19H28N2O/c1-4-6-7-15(5-2)19(22)20-11-10-16-13-21-18-9-8-14(3)12-17(16)18/h8-9,12-13,15,21H,4-7,10-11H2,1-3H3,(H,20,22)
InChIKeyLLUVOKGTTOXMGI-UHFFFAOYSA-N
MW300.45 g/mol
LogP4.35
Rot. Bonds8

About 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide

2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide (PubChem CID 17271853) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide
PubChem CID17271853
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC Name2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide
SMILESCCCCC(CC)C(=O)NCCc1c[nH]c2ccc(C)cc12
InChIInChI=1S/C19H28N2O/c1-4-6-7-15(5-2)19(22)20-11-10-16-13-21-18-9-8-14(3)12-17(16)18/h8-9,12-13,15,21H,4-7,10-11H2,1-3H3,(H,20,22)
InChIKeyLLUVOKGTTOXMGI-UHFFFAOYSA-N
XLogP4.35
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-ethylhexanamide
CID 17271856
2-chloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17339304
2-methoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17271899
2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
CID 17271734
(2S)-2-amino-N-[2-(1H-indol-3-yl)ethyl]hexanamide
CID 103830896
2-(4-hydroxypiperidin-1-yl)-N-[2-(5-methyl-1H-indol-3-yl)ethyl]propanamide
CID 167780744
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-4-nitrobenzamide
CID 2038867
N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine
CID 166670394
2-hydroxy-N-[2-(1H-indol-3-yl)ethyl]pentadecanamide
CID 90754390
(E)-2-methyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide
CID 17271955
5-chloro-2-methoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
CID 2988910
2,4-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
CID 17271778

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide?
The IUPAC name of 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide (CID 17271853) is 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide.
What is the SMILES notation for 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide?
The canonical SMILES for 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide is CCCCC(CC)C(=O)NCCc1c[nH]c2ccc(C)cc12.
What is the InChIKey of 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide?
The InChIKey is LLUVOKGTTOXMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-4-6-7-15(5-2)19(22)20-11-10-16-13-21-18-9-8-14(3)12-17(16)18/h8-9,12-13,15,21H,4-7,10-11H2,1-3H3,(H,20,22).
What are the key properties of 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide?
2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide has a molecular weight of 300.45 g/mol, XLogP of 4.35, 8 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide is sourced from PubChem (CID 17271853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).