N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide

C16H16F3N3O2S — CID 48524260

IUPACN-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
SMILESCCc1nc(CC(=O)Nc2cc(C(F)(F)F)ccc2NC(C)=O)cs1
InChIInChI=1S/C16H16F3N3O2S/c1-3-15-21-11(8-25-15)7-14(24)22-13-6-10(16(17,18)19)4-5-12(13)20-9(2)23/h4-6,8H,3,7H2,1-2H3,(H,20,23)(H,22,24)
InChIKeyVOLRVKMRLSPNKP-UHFFFAOYSA-N
MW371.38 g/mol
LogP3.86
Rot. Bonds5

About N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide

N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide (PubChem CID 48524260) has the molecular formula C16H16F3N3O2S and a molecular weight of 371.38 g/mol. Its IUPAC name is N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
PubChem CID48524260
Molecular FormulaC16H16F3N3O2S
Molecular Weight371.38 g/mol
Exact Mass371.09
IUPAC NameN-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
SMILESCCc1nc(CC(=O)Nc2cc(C(F)(F)F)ccc2NC(C)=O)cs1
InChIInChI=1S/C16H16F3N3O2S/c1-3-15-21-11(8-25-15)7-14(24)22-13-6-10(16(17,18)19)4-5-12(13)20-9(2)23/h4-6,8H,3,7H2,1-2H3,(H,20,23)(H,22,24)
InChIKeyVOLRVKMRLSPNKP-UHFFFAOYSA-N
XLogP3.86
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.38
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide (CID 48524260) is N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide is CCc1nc(CC(=O)Nc2cc(C(F)(F)F)ccc2NC(C)=O)cs1.
What is the InChIKey of N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is VOLRVKMRLSPNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F3N3O2S/c1-3-15-21-11(8-25-15)7-14(24)22-13-6-10(16(17,18)19)4-5-12(13)20-9(2)23/h4-6,8H,3,7H2,1-2H3,(H,20,23)(H,22,24).
What are the key properties of N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide?
N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 371.38 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-acetamido-5-(trifluoromethyl)phenyl]-2-(2-ethyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 48524260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).