N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide

C12H13NOS2 — CID 155800416

IUPACN-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(-c2cccs2)s1
InChIInChI=1S/C12H13NOS2/c1-9(14)13-7-6-10-4-5-12(16-10)11-3-2-8-15-11/h2-5,8H,6-7H2,1H3,(H,13,14)
InChIKeyAXVQFWOZCYXCBX-UHFFFAOYSA-N
MW251.38 g/mol
LogP3.16
Rot. Bonds4

About N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide

N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide (PubChem CID 155800416) has the molecular formula C12H13NOS2 and a molecular weight of 251.38 g/mol. Its IUPAC name is N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide
PubChem CID155800416
Molecular FormulaC12H13NOS2
Molecular Weight251.38 g/mol
Exact Mass251.04
IUPAC NameN-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(-c2cccs2)s1
InChIInChI=1S/C12H13NOS2/c1-9(14)13-7-6-10-4-5-12(16-10)11-3-2-8-15-11/h2-5,8H,6-7H2,1H3,(H,13,14)
InChIKeyAXVQFWOZCYXCBX-UHFFFAOYSA-N
XLogP3.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]oxamide
CID 155800302
2-(4-fluorophenyl)-N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide
CID 155801397
2-bromo-5-methoxy-N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]benzamide
CID 155801431
4-(5-thiophen-2-ylthiophen-2-yl)butanoic acid
CID 70912798
N'-(2-cyanophenyl)-N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]oxamide
CID 155801263
2-(5-thiophen-2-ylthiophen-2-yl)acetic acid
CID 70837097
[2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxoethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate
CID 26968758
N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]cyclopropanesulfonamide
CID 155800795
[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]methanol
CID 15838027
N-[2-(5-acetylthiophen-2-yl)ethyl]thiophene-2-carboxamide
CID 91817323
[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]methyl 2-methylprop-2-enoate
CID 86183810
[2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxoethyl] 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetate
CID 55995068

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide?
The IUPAC name of N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide (CID 155800416) is N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide is CC(=O)NCCc1ccc(-c2cccs2)s1.
What is the InChIKey of N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide?
The InChIKey is AXVQFWOZCYXCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NOS2/c1-9(14)13-7-6-10-4-5-12(16-10)11-3-2-8-15-11/h2-5,8H,6-7H2,1H3,(H,13,14).
What are the key properties of N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide?
N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide has a molecular weight of 251.38 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-thiophen-2-ylthiophen-2-yl)ethyl]acetamide is sourced from PubChem (CID 155800416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).