N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

C13H14N2O2S — CID 7541017

IUPACN-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2csc(C)n2)cc1
InChIInChI=1S/C13H14N2O2S/c1-9-14-11(8-18-9)7-13(16)15-10-3-5-12(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16)
InChIKeyLQZITMLQRDSZDB-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.64
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (PubChem CID 7541017) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
PubChem CID7541017
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC NameN-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2csc(C)n2)cc1
InChIInChI=1S/C13H14N2O2S/c1-9-14-11(8-18-9)7-13(16)15-10-3-5-12(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16)
InChIKeyLQZITMLQRDSZDB-UHFFFAOYSA-N
XLogP2.64
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (CID 7541017) is N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is COc1ccc(NC(=O)Cc2csc(C)n2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is LQZITMLQRDSZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-9-14-11(8-18-9)7-13(16)15-10-3-5-12(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16).
What are the key properties of N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 262.33 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 7541017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).