2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide

C16H13ClN2O2S2 — CID 1291535

IUPAC2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C16H13ClN2O2S2/c1-10-7-11(17)4-5-13(10)21-8-15(20)19-16-18-12(9-23-16)14-3-2-6-22-14/h2-7,9H,8H2,1H3,(H,18,19,20)
InChIKeyGQEAYYMVEMMALD-UHFFFAOYSA-N
MW364.88 g/mol
LogP4.85
Rot. Bonds5

About 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide

2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 1291535) has the molecular formula C16H13ClN2O2S2 and a molecular weight of 364.88 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID1291535
Molecular FormulaC16H13ClN2O2S2
Molecular Weight364.88 g/mol
Exact Mass364.01
IUPAC Name2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C16H13ClN2O2S2/c1-10-7-11(17)4-5-13(10)21-8-15(20)19-16-18-12(9-23-16)14-3-2-6-22-14/h2-7,9H,8H2,1H3,(H,18,19,20)
InChIKeyGQEAYYMVEMMALD-UHFFFAOYSA-N
XLogP4.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.88
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-chlorophenoxy)-N-(4-(thiophen-2-yl)thiazol-2-yl)acetamide
CID 2359907
2-(2-chlorophenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
CID 2467064
2-phenoxy-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
CID 2997799
2-(4-chloro-2-methylphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 4599824
2-(4-Chloro-phenoxy)-N-{4-[4-(morpholine-4-sulfonyl)-phenyl]-thiazol-2-yl}-acetamide
CID 980197
N-(4-(4-Chlorophenyl)-1,3-thiazol-2-YL)-2-(2-methoxyphenoxy)acetamide
CID 1275131
N-(4-(4-Chlorophenyl)-1,3-thiazol-2-YL)-2-(4-methoxyphenoxy)acetamide
CID 1326290
2-(4-chloro-2-methylphenoxy)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)acetamide
CID 2463651
2-(4-chlorophenoxy)-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetamide
CID 979319
2-(4-chlorophenoxy)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide
CID 1153682
2-(4-chlorophenoxy)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
CID 1075046
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(4-chloro-3-methylphenoxy)acetamide
CID 1183680

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide (CID 1291535) is 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide is Cc1cc(Cl)ccc1OCC(=O)Nc1nc(-c2cccs2)cs1.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is GQEAYYMVEMMALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O2S2/c1-10-7-11(17)4-5-13(10)21-8-15(20)19-16-18-12(9-23-16)14-3-2-6-22-14/h2-7,9H,8H2,1H3,(H,18,19,20).
What are the key properties of 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 364.88 g/mol, XLogP of 4.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 1291535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).