2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide

C19H22N4O3S — CID 47094229

IUPAC2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccc(-c3csc(C)n3)c2)C1=O
InChIInChI=1S/C19H22N4O3S/c1-4-19(5-2)17(25)23(18(26)22-19)10-16(24)21-14-8-6-7-13(9-14)15-11-27-12(3)20-15/h6-9,11H,4-5,10H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyQFEFOOOZEAKMMJ-UHFFFAOYSA-N
MW386.48 g/mol
LogP3.17
Rot. Bonds6

About 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide (PubChem CID 47094229) has the molecular formula C19H22N4O3S and a molecular weight of 386.48 g/mol. Its IUPAC name is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
PubChem CID47094229
Molecular FormulaC19H22N4O3S
Molecular Weight386.48 g/mol
Exact Mass386.14
IUPAC Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccc(-c3csc(C)n3)c2)C1=O
InChIInChI=1S/C19H22N4O3S/c1-4-19(5-2)17(25)23(18(26)22-19)10-16(24)21-14-8-6-7-13(9-14)15-11-27-12(3)20-15/h6-9,11H,4-5,10H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyQFEFOOOZEAKMMJ-UHFFFAOYSA-N
XLogP3.17
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.48
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide (CID 47094229) is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The canonical SMILES for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide is CCC1(CC)NC(=O)N(CC(=O)Nc2cccc(-c3csc(C)n3)c2)C1=O.
What is the InChIKey of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The InChIKey is QFEFOOOZEAKMMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3S/c1-4-19(5-2)17(25)23(18(26)22-19)10-16(24)21-14-8-6-7-13(9-14)15-11-27-12(3)20-15/h6-9,11H,4-5,10H2,1-3H3,(H,21,24)(H,22,26).
What are the key properties of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide has a molecular weight of 386.48 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 47094229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).