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

C14H16N2O2S — CID 29454557

IUPACN-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCOc1ccccc1CNC(=O)Cc1csc(C)n1
InChIInChI=1S/C14H16N2O2S/c1-10-16-12(9-19-10)7-14(17)15-8-11-5-3-4-6-13(11)18-2/h3-6,9H,7-8H2,1-2H3,(H,15,17)
InChIKeyJFXHRCFACVGKMZ-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.32
Rot. Bonds5

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

N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide (PubChem CID 29454557) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
PubChem CID29454557
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCOc1ccccc1CNC(=O)Cc1csc(C)n1
InChIInChI=1S/C14H16N2O2S/c1-10-16-12(9-19-10)7-14(17)15-8-11-5-3-4-6-13(11)18-2/h3-6,9H,7-8H2,1-2H3,(H,15,17)
InChIKeyJFXHRCFACVGKMZ-UHFFFAOYSA-N
XLogP2.32
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide (CID 29454557) is N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide is COc1ccccc1CNC(=O)Cc1csc(C)n1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is JFXHRCFACVGKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-10-16-12(9-19-10)7-14(17)15-8-11-5-3-4-6-13(11)18-2/h3-6,9H,7-8H2,1-2H3,(H,15,17).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 276.36 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 29454557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).