N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

C16H20N2O3S — CID 35595783

IUPACN-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)Cc2csc(C)n2)c1
InChIInChI=1S/C16H20N2O3S/c1-4-20-13-6-7-15(21-5-2)14(9-13)18-16(19)8-12-10-22-11(3)17-12/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19)
InChIKeyNKDFKBGGXXAILL-UHFFFAOYSA-N
MW320.41 g/mol
LogP3.43
Rot. Bonds7

About N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide

N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (PubChem CID 35595783) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
PubChem CID35595783
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC NameN-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)Cc2csc(C)n2)c1
InChIInChI=1S/C16H20N2O3S/c1-4-20-13-6-7-15(21-5-2)14(9-13)18-16(19)8-12-10-22-11(3)17-12/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19)
InChIKeyNKDFKBGGXXAILL-UHFFFAOYSA-N
XLogP3.43
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-diethoxyphenyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 16563479
2-[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]-N-(2,5-diethoxyphenyl)acetamide
CID 55448105
N-(2-ethoxyphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propanamide
CID 110332800
N-(4-methoxy-2,1,3-benzoxadiazol-7-yl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 131938174
N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 7541045
N-(2,5-diethoxyphenyl)-2-methylsulfanylacetamide
CID 33312505
N-(2-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 29453114
N-(2-ethylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 9123420
N-(2,5-diethoxyphenyl)-2-methoxyacetamide
CID 34737899
N-(2,5-diethoxyphenyl)-2-(propan-2-ylamino)acetamide
CID 60703669
N-(2,5-dimethylphenyl)-2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 46585808
2-(2-chlorophenyl)-N-(2,5-diethoxyphenyl)acetamide
CID 26179955

Frequently Asked Questions

What is the IUPAC name of N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide (CID 35595783) is N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is CCOc1ccc(OCC)c(NC(=O)Cc2csc(C)n2)c1.
What is the InChIKey of N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is NKDFKBGGXXAILL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-4-20-13-6-7-15(21-5-2)14(9-13)18-16(19)8-12-10-22-11(3)17-12/h6-7,9-10H,4-5,8H2,1-3H3,(H,18,19).
What are the key properties of N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide?
N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 320.41 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diethoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 35595783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).