3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide

C15H16FNO2S — CID 78779605

IUPAC3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide
SMILESO=C(CCOc1ccccc1F)NCCc1cccs1
InChIInChI=1S/C15H16FNO2S/c16-13-5-1-2-6-14(13)19-10-8-15(18)17-9-7-12-4-3-11-20-12/h1-6,11H,7-10H2,(H,17,18)
InChIKeyZCZSDVPFEZYSQD-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.02
Rot. Bonds7

About 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide

3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide (PubChem CID 78779605) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide
PubChem CID78779605
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC Name3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide
SMILESO=C(CCOc1ccccc1F)NCCc1cccs1
InChIInChI=1S/C15H16FNO2S/c16-13-5-1-2-6-14(13)19-10-8-15(18)17-9-7-12-4-3-11-20-12/h1-6,11H,7-10H2,(H,17,18)
InChIKeyZCZSDVPFEZYSQD-UHFFFAOYSA-N
XLogP3.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-fluorophenoxy)ethyl]thiophene
CID 64764713
3-(2-fluorophenoxy)-N-(2-hydroxyethyl)propanamide
CID 43388959
N-(2-aminoethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119382925
3-(2-fluorophenoxy)-N-propylpropanamide
CID 60637780
N-[2-(1-benzothiophen-3-yl)ethyl]-3-(2-fluorophenoxy)propanamide
CID 87005696
N-[2-(ethylamino)ethyl]-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119505851
3-bromo-N-(2-thiophen-2-ylethyl)propanamide
CID 82109303
4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
CID 13185709
4-[3-(2-fluorophenoxy)propanoylamino]-2-methylbutanoic acid
CID 80538101
(2-fluorophenyl) 4-thiophen-2-ylbutanoate
CID 78777100
2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
3-(2,5-dimethylphenoxy)-N-[2-(2-fluorophenoxy)ethyl]propanamide
CID 7927608

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide?
The IUPAC name of 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide (CID 78779605) is 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide.
What is the SMILES notation for 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide?
The canonical SMILES for 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide is O=C(CCOc1ccccc1F)NCCc1cccs1.
What is the InChIKey of 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide?
The InChIKey is ZCZSDVPFEZYSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c16-13-5-1-2-6-14(13)19-10-8-15(18)17-9-7-12-4-3-11-20-12/h1-6,11H,7-10H2,(H,17,18).
What are the key properties of 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide?
3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide has a molecular weight of 293.36 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenoxy)-N-(2-thiophen-2-ylethyl)propanamide is sourced from PubChem (CID 78779605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).