2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide

C14H14FNOS — CID 42889680

IUPAC2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide
SMILESCC(NC(=O)Cc1cccc(F)c1)c1cccs1
InChIInChI=1S/C14H14FNOS/c1-10(13-6-3-7-18-13)16-14(17)9-11-4-2-5-12(15)8-11/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyCLJQMNOZDVURAE-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.31
Rot. Bonds4

About 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide

2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide (PubChem CID 42889680) has the molecular formula C14H14FNOS and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide
PubChem CID42889680
Molecular FormulaC14H14FNOS
Molecular Weight263.34 g/mol
Exact Mass263.08
IUPAC Name2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide
SMILESCC(NC(=O)Cc1cccc(F)c1)c1cccs1
InChIInChI=1S/C14H14FNOS/c1-10(13-6-3-7-18-13)16-14(17)9-11-4-2-5-12(15)8-11/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyCLJQMNOZDVURAE-UHFFFAOYSA-N
XLogP3.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 26533
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CID 5289378
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CID 15984018
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CID 25023796
CID 25023798
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CID 25023812
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CID 566340
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CID 841341
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CID 1224525
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CID 2255653
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CID 728650
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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide (CID 42889680) is 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide is CC(NC(=O)Cc1cccc(F)c1)c1cccs1.
What is the InChIKey of 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide?
The InChIKey is CLJQMNOZDVURAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNOS/c1-10(13-6-3-7-18-13)16-14(17)9-11-4-2-5-12(15)8-11/h2-8,10H,9H2,1H3,(H,16,17).
What are the key properties of 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide?
2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide has a molecular weight of 263.34 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-(1-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 42889680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).