N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide

C18H24N2O4S — CID 47871223

IUPACN-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCCc1nc(CN(C)C(=O)Cc2cc(OC)c(OC)c(OC)c2)cs1
InChIInChI=1S/C18H24N2O4S/c1-6-16-19-13(11-25-16)10-20(2)17(21)9-12-7-14(22-3)18(24-5)15(8-12)23-4/h7-8,11H,6,9-10H2,1-5H3
InChIKeyUEAJXPGHLLDHDI-UHFFFAOYSA-N
MW364.47 g/mol
LogP2.93
Rot. Bonds8

About N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide

N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 47871223) has the molecular formula C18H24N2O4S and a molecular weight of 364.47 g/mol. Its IUPAC name is N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID47871223
Molecular FormulaC18H24N2O4S
Molecular Weight364.47 g/mol
Exact Mass364.15
IUPAC NameN-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCCc1nc(CN(C)C(=O)Cc2cc(OC)c(OC)c(OC)c2)cs1
InChIInChI=1S/C18H24N2O4S/c1-6-16-19-13(11-25-16)10-20(2)17(21)9-12-7-14(22-3)18(24-5)15(8-12)23-4/h7-8,11H,6,9-10H2,1-5H3
InChIKeyUEAJXPGHLLDHDI-UHFFFAOYSA-N
XLogP2.93
TPSA60.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide (CID 47871223) is N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide is CCc1nc(CN(C)C(=O)Cc2cc(OC)c(OC)c(OC)c2)cs1.
What is the InChIKey of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is UEAJXPGHLLDHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4S/c1-6-16-19-13(11-25-16)10-20(2)17(21)9-12-7-14(22-3)18(24-5)15(8-12)23-4/h7-8,11H,6,9-10H2,1-5H3.
What are the key properties of N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide?
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 364.47 g/mol, XLogP of 2.93, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 47871223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).