2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide

C19H17FN2O2S — CID 18145127

IUPAC2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)Cc1csc(COc2ccc(F)cc2)n1)c1ccccc1
InChIInChI=1S/C19H17FN2O2S/c1-22(16-5-3-2-4-6-16)19(23)11-15-13-25-18(21-15)12-24-17-9-7-14(20)8-10-17/h2-10,13H,11-12H2,1H3
InChIKeyQCFAZGNWXWROBC-UHFFFAOYSA-N
MW356.42 g/mol
LogP4.07
Rot. Bonds6

About 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide

2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide (PubChem CID 18145127) has the molecular formula C19H17FN2O2S and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide
PubChem CID18145127
Molecular FormulaC19H17FN2O2S
Molecular Weight356.42 g/mol
Exact Mass356.10
IUPAC Name2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)Cc1csc(COc2ccc(F)cc2)n1)c1ccccc1
InChIInChI=1S/C19H17FN2O2S/c1-22(16-5-3-2-4-6-16)19(23)11-15-13-25-18(21-15)12-24-17-9-7-14(20)8-10-17/h2-10,13H,11-12H2,1H3
InChIKeyQCFAZGNWXWROBC-UHFFFAOYSA-N
XLogP4.07
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide 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 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide (CID 18145127) is 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide is CN(C(=O)Cc1csc(COc2ccc(F)cc2)n1)c1ccccc1.
What is the InChIKey of 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide?
The InChIKey is QCFAZGNWXWROBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2S/c1-22(16-5-3-2-4-6-16)19(23)11-15-13-25-18(21-15)12-24-17-9-7-14(20)8-10-17/h2-10,13H,11-12H2,1H3.
What are the key properties of 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide?
2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide has a molecular weight of 356.42 g/mol, XLogP of 4.07, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 18145127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).