2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide

C20H16N2O3S — CID 1091506

IUPAC2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cn1cc(C(=O)c2ccco2)c2ccccc21)NCc1cccs1
InChIInChI=1S/C20H16N2O3S/c23-19(21-11-14-5-4-10-26-14)13-22-12-16(15-6-1-2-7-17(15)22)20(24)18-8-3-9-25-18/h1-10,12H,11,13H2,(H,21,23)
InChIKeyYZIGRGHBHOADRX-UHFFFAOYSA-N
MW364.43 g/mol
LogP3.84
Rot. Bonds6

About 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide

2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 1091506) has the molecular formula C20H16N2O3S and a molecular weight of 364.43 g/mol. Its IUPAC name is 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
PubChem CID1091506
Molecular FormulaC20H16N2O3S
Molecular Weight364.43 g/mol
Exact Mass364.09
IUPAC Name2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cn1cc(C(=O)c2ccco2)c2ccccc21)NCc1cccs1
InChIInChI=1S/C20H16N2O3S/c23-19(21-11-14-5-4-10-26-14)13-22-12-16(15-6-1-2-7-17(15)22)20(24)18-8-3-9-25-18/h1-10,12H,11,13H2,(H,21,23)
InChIKeyYZIGRGHBHOADRX-UHFFFAOYSA-N
XLogP3.84
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide (CID 1091506) is 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide is O=C(Cn1cc(C(=O)c2ccco2)c2ccccc21)NCc1cccs1.
What is the InChIKey of 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is YZIGRGHBHOADRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3S/c23-19(21-11-14-5-4-10-26-14)13-22-12-16(15-6-1-2-7-17(15)22)20(24)18-8-3-9-25-18/h1-10,12H,11,13H2,(H,21,23).
What are the key properties of 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide?
2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 364.43 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(furan-2-carbonyl)indol-1-yl]-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 1091506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).