2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide

C15H19N3O2 — CID 11196581

IUPAC2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
SMILESCC(=O)NCC(=O)NCCc1cn(C)c2ccccc12
InChIInChI=1S/C15H19N3O2/c1-11(19)17-9-15(20)16-8-7-12-10-18(2)14-6-4-3-5-13(12)14/h3-6,10H,7-9H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyQOXMLWXFYAPGQN-UHFFFAOYSA-N
MW273.34 g/mol
LogP0.97
Rot. Bonds5

About 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide

2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide (PubChem CID 11196581) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
PubChem CID11196581
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
SMILESCC(=O)NCC(=O)NCCc1cn(C)c2ccccc12
InChIInChI=1S/C15H19N3O2/c1-11(19)17-9-15(20)16-8-7-12-10-18(2)14-6-4-3-5-13(12)14/h3-6,10H,7-9H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyQOXMLWXFYAPGQN-UHFFFAOYSA-N
XLogP0.97
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 82495529
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
methyl N-[2-(1-methylindol-3-yl)ethyl]carbamate
CID 14613226
N-[2-(1-methylindol-3-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110731525
N-(2-aminoethyl)-2-(1-methylindol-3-yl)acetamide
CID 82289252
N-[2-[1-(hydroxymethyl)indol-3-yl]ethyl]acetamide
CID 102296524
N-ethyl-3-(1-methylindol-3-yl)propanamide
CID 167074114
N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide
CID 45069388
3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 71702593
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
1-cyclopentyl-3-[2-(1-methylindol-3-yl)ethyl]urea
CID 110748890
N-[(1-methylindol-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 115158236

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The IUPAC name of 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide (CID 11196581) is 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide is CC(=O)NCC(=O)NCCc1cn(C)c2ccccc12.
What is the InChIKey of 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
The InChIKey is QOXMLWXFYAPGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(19)17-9-15(20)16-8-7-12-10-18(2)14-6-4-3-5-13(12)14/h3-6,10H,7-9H2,1-2H3,(H,16,20)(H,17,19).
What are the key properties of 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide?
2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide has a molecular weight of 273.34 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide is sourced from PubChem (CID 11196581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).