N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide

C17H14ClN3O2S — CID 28865136

IUPACN-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide
SMILESNc1nc(-c2cccc(NC(=O)COc3ccc(Cl)cc3)c2)cs1
InChIInChI=1S/C17H14ClN3O2S/c18-12-4-6-14(7-5-12)23-9-16(22)20-13-3-1-2-11(8-13)15-10-24-17(19)21-15/h1-8,10H,9H2,(H2,19,21)(H,20,22)
InChIKeyUJAQDDLFBYNXFH-UHFFFAOYSA-N
MW359.84 g/mol
LogP4.06
Rot. Bonds5

About N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide

N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide (PubChem CID 28865136) has the molecular formula C17H14ClN3O2S and a molecular weight of 359.84 g/mol. Its IUPAC name is N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide.

Molecular Properties

Compound NameN-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide
PubChem CID28865136
Molecular FormulaC17H14ClN3O2S
Molecular Weight359.84 g/mol
Exact Mass359.05
IUPAC NameN-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide
SMILESNc1nc(-c2cccc(NC(=O)COc3ccc(Cl)cc3)c2)cs1
InChIInChI=1S/C17H14ClN3O2S/c18-12-4-6-14(7-5-12)23-9-16(22)20-13-3-1-2-11(8-13)15-10-24-17(19)21-15/h1-8,10H,9H2,(H2,19,21)(H,20,22)
InChIKeyUJAQDDLFBYNXFH-UHFFFAOYSA-N
XLogP4.06
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.84
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-ethylphenoxy)acetamide
CID 28865252
2-(4-chlorophenoxy)-N-[3-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 1195308
2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-phenylacetamide
CID 28856207
N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-phenylacetamide
CID 28865111
2-(4-chlorophenoxy)-N-[3-(1H-imidazol-5-yl)phenyl]acetamide
CID 110668566
2-(4-chlorophenoxy)-N-[3-[6-(2,5-dimethoxyphenyl)-2-pyridinyl]phenyl]acetamide
CID 46087670
2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(4-ethoxyphenyl)acetamide
CID 28856284
2-[3-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(2,6-diethylphenyl)acetamide
CID 28857104
2-(4-chlorophenoxy)-N-(3-iodophenyl)acetamide
CID 7738324
2-(4-chloro-2-propanoylphenoxy)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 8891121
N-[3-[2-(3-fluoroanilino)-1,3-thiazol-4-yl]phenyl]-2-phenoxyacetamide
CID 42764865
[2-[3-(2-methyl-1,3-thiazol-4-yl)anilino]-2-oxoethyl] 2-[(2-phenoxyacetyl)amino]acetate
CID 55356708

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide?
The IUPAC name of N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide (CID 28865136) is N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide.
What is the SMILES notation for N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide?
The canonical SMILES for N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide is Nc1nc(-c2cccc(NC(=O)COc3ccc(Cl)cc3)c2)cs1.
What is the InChIKey of N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide?
The InChIKey is UJAQDDLFBYNXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O2S/c18-12-4-6-14(7-5-12)23-9-16(22)20-13-3-1-2-11(8-13)15-10-24-17(19)21-15/h1-8,10H,9H2,(H2,19,21)(H,20,22).
What are the key properties of N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide?
N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide has a molecular weight of 359.84 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-amino-1,3-thiazol-4-yl)phenyl]-2-(4-chlorophenoxy)acetamide is sourced from PubChem (CID 28865136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).