N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide

C18H17FN2O2S — CID 24627803

IUPACN-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
SMILESCCN(C(=O)Cc1nc(-c2cccs2)oc1C)c1ccc(F)cc1
InChIInChI=1S/C18H17FN2O2S/c1-3-21(14-8-6-13(19)7-9-14)17(22)11-15-12(2)23-18(20-15)16-5-4-10-24-16/h4-10H,3,11H2,1-2H3
InChIKeyPIXKEAWNXRHARP-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.45
Rot. Bonds5

About N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide

N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide (PubChem CID 24627803) has the molecular formula C18H17FN2O2S and a molecular weight of 344.41 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
PubChem CID24627803
Molecular FormulaC18H17FN2O2S
Molecular Weight344.41 g/mol
Exact Mass344.10
IUPAC NameN-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
SMILESCCN(C(=O)Cc1nc(-c2cccs2)oc1C)c1ccc(F)cc1
InChIInChI=1S/C18H17FN2O2S/c1-3-21(14-8-6-13(19)7-9-14)17(22)11-15-12(2)23-18(20-15)16-5-4-10-24-16/h4-10H,3,11H2,1-2H3
InChIKeyPIXKEAWNXRHARP-UHFFFAOYSA-N
XLogP4.45
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide (CID 24627803) is N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide is CCN(C(=O)Cc1nc(-c2cccs2)oc1C)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide?
The InChIKey is PIXKEAWNXRHARP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2S/c1-3-21(14-8-6-13(19)7-9-14)17(22)11-15-12(2)23-18(20-15)16-5-4-10-24-16/h4-10H,3,11H2,1-2H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide?
N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide has a molecular weight of 344.41 g/mol, XLogP of 4.45, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 24627803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).