2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide

C19H19N3OS — CID 27377774

IUPAC2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2csc(Nc3ccccc3)n2)c1C
InChIInChI=1S/C19H19N3OS/c1-13-7-6-10-17(14(13)2)22-18(23)11-16-12-24-19(21-16)20-15-8-4-3-5-9-15/h3-10,12H,11H2,1-2H3,(H,20,21)(H,22,23)
InChIKeyLJEIVRBLFMYZNM-UHFFFAOYSA-N
MW337.45 g/mol
LogP4.68
Rot. Bonds5

About 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide

2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide (PubChem CID 27377774) has the molecular formula C19H19N3OS and a molecular weight of 337.45 g/mol. Its IUPAC name is 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide
PubChem CID27377774
Molecular FormulaC19H19N3OS
Molecular Weight337.45 g/mol
Exact Mass337.12
IUPAC Name2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2csc(Nc3ccccc3)n2)c1C
InChIInChI=1S/C19H19N3OS/c1-13-7-6-10-17(14(13)2)22-18(23)11-16-12-24-19(21-16)20-15-8-4-3-5-9-15/h3-10,12H,11H2,1-2H3,(H,20,21)(H,22,23)
InChIKeyLJEIVRBLFMYZNM-UHFFFAOYSA-N
XLogP4.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide (CID 27377774) is 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)Cc2csc(Nc3ccccc3)n2)c1C.
What is the InChIKey of 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is LJEIVRBLFMYZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3OS/c1-13-7-6-10-17(14(13)2)22-18(23)11-16-12-24-19(21-16)20-15-8-4-3-5-9-15/h3-10,12H,11H2,1-2H3,(H,20,21)(H,22,23).
What are the key properties of 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide?
2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 337.45 g/mol, XLogP of 4.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-anilino-1,3-thiazol-4-yl)-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 27377774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).