2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide

C18H15FN2OS — CID 38765206

IUPAC2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(Cc1csc(Cc2ccccc2)n1)Nc1ccccc1F
InChIInChI=1S/C18H15FN2OS/c19-15-8-4-5-9-16(15)21-17(22)11-14-12-23-18(20-14)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)
InChIKeyOUWABMSYNIXKKG-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.05
Rot. Bonds5

About 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide

2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 38765206) has the molecular formula C18H15FN2OS and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide
PubChem CID38765206
Molecular FormulaC18H15FN2OS
Molecular Weight326.40 g/mol
Exact Mass326.09
IUPAC Name2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(Cc1csc(Cc2ccccc2)n1)Nc1ccccc1F
InChIInChI=1S/C18H15FN2OS/c19-15-8-4-5-9-16(15)21-17(22)11-14-12-23-18(20-14)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)
InChIKeyOUWABMSYNIXKKG-UHFFFAOYSA-N
XLogP4.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
CID 119383166
2-(2-benzyl-1,3-thiazol-4-yl)-N-(5-chloro-2-ethoxyphenyl)acetamide
CID 55890045
N-(5-acetamido-2-fluorophenyl)-2-[2-[(3-chlorophenyl)methyl]-1,3-thiazol-4-yl]acetamide
CID 43069303
2-[2-[2-(aminomethyl)phenyl]-1,3-thiazol-4-yl]-N-(2-fluorophenyl)acetamide
CID 110450485
N-(2-fluorophenyl)-2-[2-[(6-methyl-3-pyridinyl)oxymethyl]-1,3-thiazol-4-yl]acetamide
CID 110341908
2-[[2-(2-benzyl-1,3-thiazol-4-yl)acetyl]amino]propanoic acid
CID 119225580
N-[(2-benzyl-1,3-thiazol-4-yl)methyl]-2-fluorobenzamide
CID 108760464
N-(1-benzylpyrazol-4-yl)-2-(2-benzyl-1,3-thiazol-4-yl)acetamide
CID 55948097
N-[(2-benzyl-1,3-thiazol-4-yl)methyl]-2-(3,5-difluorophenyl)acetamide
CID 86284851
2-(2-benzyl-1,3-thiazol-4-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 39896236
2-(2-benzyl-1,3-thiazol-4-yl)-N-(3-bromo-4-methylphenyl)acetamide
CID 55671045
ethyl 2-[2-[[2-(2-benzyl-1,3-thiazol-4-yl)acetyl]amino]-1,3-thiazol-4-yl]acetate
CID 55649828

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide (CID 38765206) is 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide is O=C(Cc1csc(Cc2ccccc2)n1)Nc1ccccc1F.
What is the InChIKey of 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is OUWABMSYNIXKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2OS/c19-15-8-4-5-9-16(15)21-17(22)11-14-12-23-18(20-14)10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22).
What are the key properties of 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide?
2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzyl-1,3-thiazol-4-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 38765206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).