2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide

C17H15N3O2S — CID 28856207

IUPAC2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide
SMILESNc1nc(-c2ccc(OCC(=O)Nc3ccccc3)cc2)cs1
InChIInChI=1S/C17H15N3O2S/c18-17-20-15(11-23-17)12-6-8-14(9-7-12)22-10-16(21)19-13-4-2-1-3-5-13/h1-9,11H,10H2,(H2,18,20)(H,19,21)
InChIKeyKAQWMAVHWIBPSG-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.41
Rot. Bonds5

About 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide

2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide (PubChem CID 28856207) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide
PubChem CID28856207
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC Name2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide
SMILESNc1nc(-c2ccc(OCC(=O)Nc3ccccc3)cc2)cs1
InChIInChI=1S/C17H15N3O2S/c18-17-20-15(11-23-17)12-6-8-14(9-7-12)22-10-16(21)19-13-4-2-1-3-5-13/h1-9,11H,10H2,(H2,18,20)(H,19,21)
InChIKeyKAQWMAVHWIBPSG-UHFFFAOYSA-N
XLogP3.41
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(4-ethoxyphenyl)acetamide
CID 28856284
2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(2-ethylphenyl)acetamide
CID 28856245
N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide
CID 28865136
N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-ethylphenoxy)acetamide
CID 28865252
N-[4-(4-aminophenyl)-1,3-thiazol-2-yl]-2-phenoxyacetamide
CID 28861376
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-3-phenylpropanamide
CID 28865127
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]propanamide
CID 896768
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-(4-phenylphenoxy)acetamide
CID 19178667
N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
CID 4511463
N-[2-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-ethoxyphenoxy)acetamide
CID 28865232
2-(4-tert-butylphenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 19178615
N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-phenylacetamide
CID 28865111

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide (CID 28856207) is 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide is Nc1nc(-c2ccc(OCC(=O)Nc3ccccc3)cc2)cs1.
What is the InChIKey of 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide?
The InChIKey is KAQWMAVHWIBPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c18-17-20-15(11-23-17)12-6-8-14(9-7-12)22-10-16(21)19-13-4-2-1-3-5-13/h1-9,11H,10H2,(H2,18,20)(H,19,21).
What are the key properties of 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide?
2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide has a molecular weight of 325.39 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide is sourced from PubChem (CID 28856207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).