N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide

C16H16N2OS — CID 5095670

IUPACN-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCn1ccc2ccccc21
InChIInChI=1S/C16H16N2OS/c19-16(12-14-5-3-11-20-14)17-8-10-18-9-7-13-4-1-2-6-15(13)18/h1-7,9,11H,8,10,12H2,(H,17,19)
InChIKeyCKFULYHCDPCEHL-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.06
Rot. Bonds5

About N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide

N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide (PubChem CID 5095670) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide
PubChem CID5095670
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC NameN-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCn1ccc2ccccc21
InChIInChI=1S/C16H16N2OS/c19-16(12-14-5-3-11-20-14)17-8-10-18-9-7-13-4-1-2-6-15(13)18/h1-7,9,11H,8,10,12H2,(H,17,19)
InChIKeyCKFULYHCDPCEHL-UHFFFAOYSA-N
XLogP3.06
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide (CID 5095670) is N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCCn1ccc2ccccc21.
What is the InChIKey of N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide?
The InChIKey is CKFULYHCDPCEHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2OS/c19-16(12-14-5-3-11-20-14)17-8-10-18-9-7-13-4-1-2-6-15(13)18/h1-7,9,11H,8,10,12H2,(H,17,19).
What are the key properties of N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide?
N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide has a molecular weight of 284.38 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-indol-1-ylethyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 5095670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).