N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide

C14H8Cl2FN3O3S — CID 43972882

IUPACN-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)Nc1nnc(-c2cc(Cl)sc2Cl)o1
InChIInChI=1S/C14H8Cl2FN3O3S/c15-10-5-7(12(16)24-10)13-19-20-14(23-13)18-11(21)6-22-9-4-2-1-3-8(9)17/h1-5H,6H2,(H,18,20,21)
InChIKeyGYFYPWBVDBGKFV-UHFFFAOYSA-N
MW388.21 g/mol
LogP4.26
Rot. Bonds5

About N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide

N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide (PubChem CID 43972882) has the molecular formula C14H8Cl2FN3O3S and a molecular weight of 388.21 g/mol. Its IUPAC name is N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide
PubChem CID43972882
Molecular FormulaC14H8Cl2FN3O3S
Molecular Weight388.21 g/mol
Exact Mass386.96
IUPAC NameN-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide
SMILESO=C(COc1ccccc1F)Nc1nnc(-c2cc(Cl)sc2Cl)o1
InChIInChI=1S/C14H8Cl2FN3O3S/c15-10-5-7(12(16)24-10)13-19-20-14(23-13)18-11(21)6-22-9-4-2-1-3-8(9)17/h1-5H,6H2,(H,18,20,21)
InChIKeyGYFYPWBVDBGKFV-UHFFFAOYSA-N
XLogP4.26
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.21
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-(5-chlorothiophen-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenoxyacetamide
CID 2104603
N-[5-(5-chlorothiophen-2-yl)-1,3,4-oxadiazol-2-yl]-2-(2,4-dichlorophenoxy)acetamide
CID 3466279
2-(2-fluorophenoxy)-N-(5-(4-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl)acetamide
CID 56763936
N-(5-(5-chlorothiophen-2-yl)-1,3,4-oxadiazol-2-yl)-3-phenoxypropanamide
CID 4194354
2-(4-chlorophenoxy)-N-(5-(thiophen-2-ylmethyl)-1,3,4-oxadiazol-2-yl)acetamide
CID 42110010
N-(5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carboxamide
CID 43972978
2,5-dichloro-N-[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]thiophene-3-carboxamide
CID 52904187
N-[5-(5-chlorothiophen-2-yl)-1,3,4-oxadiazol-2-yl]-4-ethoxybenzamide
CID 4251587
3-butoxy-N-[5-(5-chlorothiophen-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 2104567
N-(5-((5-chlorothiophen-2-yl)methyl)-1,3,4-oxadiazol-2-yl)-2-phenoxyacetamide
CID 25284412
N-[5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]-2-(4-chlorophenoxy)acetamide
CID 42110863
N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide
CID 43972848

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide (CID 43972882) is N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide is O=C(COc1ccccc1F)Nc1nnc(-c2cc(Cl)sc2Cl)o1.
What is the InChIKey of N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide?
The InChIKey is GYFYPWBVDBGKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2FN3O3S/c15-10-5-7(12(16)24-10)13-19-20-14(23-13)18-11(21)6-22-9-4-2-1-3-8(9)17/h1-5H,6H2,(H,18,20,21).
What are the key properties of N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide?
N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide has a molecular weight of 388.21 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,5-dichlorothiophen-3-yl)-1,3,4-oxadiazol-2-yl]-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 43972882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).