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

C15H18N2O2S — CID 7119099

IUPAC2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCOc1ccc(CC(=O)NCCc2csc(C)n2)cc1
InChIInChI=1S/C15H18N2O2S/c1-11-17-13(10-20-11)7-8-16-15(18)9-12-3-5-14(19-2)6-4-12/h3-6,10H,7-9H2,1-2H3,(H,16,18)
InChIKeyJEOXEGLMVQTVOK-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.36
Rot. Bonds6

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

2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide (PubChem CID 7119099) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
PubChem CID7119099
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCOc1ccc(CC(=O)NCCc2csc(C)n2)cc1
InChIInChI=1S/C15H18N2O2S/c1-11-17-13(10-20-11)7-8-16-15(18)9-12-3-5-14(19-2)6-4-12/h3-6,10H,7-9H2,1-2H3,(H,16,18)
InChIKeyJEOXEGLMVQTVOK-UHFFFAOYSA-N
XLogP2.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide (CID 7119099) is 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide is COc1ccc(CC(=O)NCCc2csc(C)n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide?
The InChIKey is JEOXEGLMVQTVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-11-17-13(10-20-11)7-8-16-15(18)9-12-3-5-14(19-2)6-4-12/h3-6,10H,7-9H2,1-2H3,(H,16,18).
What are the key properties of 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide?
2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide has a molecular weight of 290.39 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 7119099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).