N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide

C19H15FN2O2S — CID 42581835

IUPACN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
SMILESCC(=O)c1ccc(NC(=O)Cc2cnc(-c3ccccc3F)s2)cc1
InChIInChI=1S/C19H15FN2O2S/c1-12(23)13-6-8-14(9-7-13)22-18(24)10-15-11-21-19(25-15)16-4-2-3-5-17(16)20/h2-9,11H,10H2,1H3,(H,22,24)
InChIKeyINFSHHSMBYUCCO-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.33
Rot. Bonds5

About N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide

N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide (PubChem CID 42581835) has the molecular formula C19H15FN2O2S and a molecular weight of 354.41 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
PubChem CID42581835
Molecular FormulaC19H15FN2O2S
Molecular Weight354.41 g/mol
Exact Mass354.08
IUPAC NameN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide
SMILESCC(=O)c1ccc(NC(=O)Cc2cnc(-c3ccccc3F)s2)cc1
InChIInChI=1S/C19H15FN2O2S/c1-12(23)13-6-8-14(9-7-13)22-18(24)10-15-11-21-19(25-15)16-4-2-3-5-17(16)20/h2-9,11H,10H2,1H3,(H,22,24)
InChIKeyINFSHHSMBYUCCO-UHFFFAOYSA-N
XLogP4.33
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide (CID 42581835) is N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide is CC(=O)c1ccc(NC(=O)Cc2cnc(-c3ccccc3F)s2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
The InChIKey is INFSHHSMBYUCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2S/c1-12(23)13-6-8-14(9-7-13)22-18(24)10-15-11-21-19(25-15)16-4-2-3-5-17(16)20/h2-9,11H,10H2,1H3,(H,22,24).
What are the key properties of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide?
N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide has a molecular weight of 354.41 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]acetamide is sourced from PubChem (CID 42581835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).