N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide

C16H15FN4OS — CID 53178285

IUPACN-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide
SMILESCc1csc(-c2cn(CC(=O)Nc3ccc(C)c(F)c3)cn2)n1
InChIInChI=1S/C16H15FN4OS/c1-10-3-4-12(5-13(10)17)20-15(22)7-21-6-14(18-9-21)16-19-11(2)8-23-16/h3-6,8-9H,7H2,1-2H3,(H,20,22)
InChIKeyKEBVWGJFUYMGKT-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.40
Rot. Bonds4

About N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide

N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide (PubChem CID 53178285) has the molecular formula C16H15FN4OS and a molecular weight of 330.39 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide
PubChem CID53178285
Molecular FormulaC16H15FN4OS
Molecular Weight330.39 g/mol
Exact Mass330.10
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide
SMILESCc1csc(-c2cn(CC(=O)Nc3ccc(C)c(F)c3)cn2)n1
InChIInChI=1S/C16H15FN4OS/c1-10-3-4-12(5-13(10)17)20-15(22)7-21-6-14(18-9-21)16-19-11(2)8-23-16/h3-6,8-9H,7H2,1-2H3,(H,20,22)
InChIKeyKEBVWGJFUYMGKT-UHFFFAOYSA-N
XLogP3.40
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-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-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide (CID 53178285) is N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide is Cc1csc(-c2cn(CC(=O)Nc3ccc(C)c(F)c3)cn2)n1.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide?
The InChIKey is KEBVWGJFUYMGKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN4OS/c1-10-3-4-12(5-13(10)17)20-15(22)7-21-6-14(18-9-21)16-19-11(2)8-23-16/h3-6,8-9H,7H2,1-2H3,(H,20,22).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide?
N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide has a molecular weight of 330.39 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)imidazol-1-yl]acetamide is sourced from PubChem (CID 53178285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).