2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide

C18H13F3N2O2S — CID 11303465

IUPAC2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide
SMILESNC(=O)Cc1nc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)cs1
InChIInChI=1S/C18H13F3N2O2S/c19-18(20,21)25-15-7-2-1-6-13(15)11-4-3-5-12(8-11)14-10-26-17(23-14)9-16(22)24/h1-8,10H,9H2,(H2,22,24)
InChIKeyAIVBRYKJFWYKFA-UHFFFAOYSA-N
MW378.38 g/mol
LogP4.40
Rot. Bonds5

About 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide

2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 11303465) has the molecular formula C18H13F3N2O2S and a molecular weight of 378.38 g/mol. Its IUPAC name is 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide
PubChem CID11303465
Molecular FormulaC18H13F3N2O2S
Molecular Weight378.38 g/mol
Exact Mass378.06
IUPAC Name2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide
SMILESNC(=O)Cc1nc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)cs1
InChIInChI=1S/C18H13F3N2O2S/c19-18(20,21)25-15-7-2-1-6-13(15)11-4-3-5-12(8-11)14-10-26-17(23-14)9-16(22)24/h1-8,10H,9H2,(H2,22,24)
InChIKeyAIVBRYKJFWYKFA-UHFFFAOYSA-N
XLogP4.40
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.38
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2'-(Trifluoromethoxy)biphenyl-3-yl)thiazole-2-carboxamide
CID 11740023
2,4-Bis(3-Methoxyphenyl)Thiazole
CID 24431784
4-(2''-(Trifluoromethoxy)biphenyl-3-yl)thiazole
CID 11427214
2-(2''-(Trifluoromethoxy)biphenyl-3-yl)thiazole-4-carboxamide
CID 11187635
N-hydroxy-7-[4-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-yl]heptanamide
CID 44349514
N-[1-[4-(3,5-difluorophenyl)-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)ethyl]acetamide
CID 46943521
N-[[4-(4-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]-phenylmethyl]acetamide
CID 46943638
N-[(3,4-difluorophenyl)-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 46948616
N-[(3-fluorophenyl)-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 49778585
N-[(3,4-difluorophenyl)-[4-(4-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 49789395
N-[[4-(4-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]-(3-fluorophenyl)methyl]acetamide
CID 49789840
N-[[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-phenylmethyl]acetamide
CID 49790361

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide (CID 11303465) is 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide is NC(=O)Cc1nc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)cs1.
What is the InChIKey of 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is AIVBRYKJFWYKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N2O2S/c19-18(20,21)25-15-7-2-1-6-13(15)11-4-3-5-12(8-11)14-10-26-17(23-14)9-16(22)24/h1-8,10H,9H2,(H2,22,24).
What are the key properties of 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide?
2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 378.38 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 11303465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).