N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide

C12H11NOS2 — CID 12666433

IUPACN-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide
SMILESCC(=O)Nc1sccc1/C=C/c1cccs1
InChIInChI=1S/C12H11NOS2/c1-9(14)13-12-10(6-8-16-12)4-5-11-3-2-7-15-11/h2-8H,1H3,(H,13,14)/b5-4+
InChIKeyMLPVZTQGXNTPPV-SNAWJCMRSA-N
MW249.36 g/mol
LogP3.94
Rot. Bonds3

About N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide

N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide (PubChem CID 12666433) has the molecular formula C12H11NOS2 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide.

Molecular Properties

Compound NameN-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide
PubChem CID12666433
Molecular FormulaC12H11NOS2
Molecular Weight249.36 g/mol
Exact Mass249.03
IUPAC NameN-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide
SMILESCC(=O)Nc1sccc1/C=C/c1cccs1
InChIInChI=1S/C12H11NOS2/c1-9(14)13-12-10(6-8-16-12)4-5-11-3-2-7-15-11/h2-8H,1H3,(H,13,14)/b5-4+
InChIKeyMLPVZTQGXNTPPV-SNAWJCMRSA-N
XLogP3.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethenylthiophen-2-yl)acetamide
CID 165358616
N-methyl-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]thiophene-3-carboxamide
CID 6245628
methyl 2-methoxy-6-(2-thiophen-2-ylethenyl)benzoate
CID 75210644
methyl 3-[(E)-2-thiophen-2-ylethenyl]benzoate
CID 155479747
3-thiophen-2-ylprop-2-enyl 3-oxobutanoate
CID 54311727
(E)-2-thiophen-2-ylethenol
CID 89297537
(E)-N-(4-hydroxyphenyl)-3-thiophen-2-ylprop-2-enamide
CID 28739526
N-[4-(dimethylamino)phenyl]-3-thiophen-2-ylprop-2-enamide
CID 3336553
CID 59090948
CID 59090948
(E)-3-thiophen-2-ylprop-2-enoic acid;hydrochloride
CID 88528301
S-[(E)-3-thiophen-2-ylprop-2-enyl] ethanethioate
CID 71663485
[(E)-3-thiophen-2-ylprop-2-enyl] acetate
CID 11298325

Frequently Asked Questions

What is the IUPAC name of N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide?
The IUPAC name of N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide (CID 12666433) is N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide.
What is the SMILES notation for N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide?
The canonical SMILES for N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide is CC(=O)Nc1sccc1/C=C/c1cccs1.
What is the InChIKey of N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide?
The InChIKey is MLPVZTQGXNTPPV-SNAWJCMRSA-N. The full InChI is InChI=1S/C12H11NOS2/c1-9(14)13-12-10(6-8-16-12)4-5-11-3-2-7-15-11/h2-8H,1H3,(H,13,14)/b5-4+.
What are the key properties of N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide?
N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide has a molecular weight of 249.36 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(E)-2-thiophen-2-ylethenyl]thiophen-2-yl]acetamide is sourced from PubChem (CID 12666433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).