2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide

C15H21N3O — CID 115158041

IUPAC2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
SMILESCCNCC(=O)NCCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C15H21N3O/c1-3-16-10-15(19)17-9-8-12-11(2)18-14-7-5-4-6-13(12)14/h4-7,16,18H,3,8-10H2,1-2H3,(H,17,19)
InChIKeyKPTYKEYFXIDFJF-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.74
Rot. Bonds6

About 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide

2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide (PubChem CID 115158041) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
PubChem CID115158041
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
SMILESCCNCC(=O)NCCc1c(C)[nH]c2ccccc12
InChIInChI=1S/C15H21N3O/c1-3-16-10-15(19)17-9-8-12-11(2)18-14-7-5-4-6-13(12)14/h4-7,16,18H,3,8-10H2,1-2H3,(H,17,19)
InChIKeyKPTYKEYFXIDFJF-UHFFFAOYSA-N
XLogP1.74
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789052
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-oxobutanamide
CID 71492148
2-(2-methyl-1H-indol-3-yl)ethylcarbamic acid
CID 115171128
2-cyano-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 115173271
2-methyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789053
N-ethyl-3-(2-methyl-1H-indol-3-yl)propan-1-amine
CID 96658400
[[8-[2-(2-methyl-1H-indol-3-yl)ethylamino]-8-oxooctanoyl]amino]oxidanium
CID 148932122
1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylurea
CID 110775881
2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
CID 31852687
2-chloro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
CID 54776329
4-(hydroxymethyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
CID 54776348
N'-[3-(2-methyl-1H-indol-3-yl)propyl]octanediamide
CID 167105628

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide (CID 115158041) is 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide is CCNCC(=O)NCCc1c(C)[nH]c2ccccc12.
What is the InChIKey of 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide?
The InChIKey is KPTYKEYFXIDFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-3-16-10-15(19)17-9-8-12-11(2)18-14-7-5-4-6-13(12)14/h4-7,16,18H,3,8-10H2,1-2H3,(H,17,19).
What are the key properties of 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide?
2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide has a molecular weight of 259.35 g/mol, XLogP of 1.74, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide is sourced from PubChem (CID 115158041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).