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

C12H16N4O3S — CID 56721443

IUPAC2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCCc1nc(C)sc1CNC(=O)CN1CC(=O)NC1=O
InChIInChI=1S/C12H16N4O3S/c1-3-8-9(20-7(2)14-8)4-13-10(17)5-16-6-11(18)15-12(16)19/h3-6H2,1-2H3,(H,13,17)(H,15,18,19)
InChIKeyKSAVYVCCQVCIFP-UHFFFAOYSA-N
MW296.35 g/mol
LogP0.18
Rot. Bonds5

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

2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide (PubChem CID 56721443) has the molecular formula C12H16N4O3S and a molecular weight of 296.35 g/mol. Its IUPAC name is 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide
PubChem CID56721443
Molecular FormulaC12H16N4O3S
Molecular Weight296.35 g/mol
Exact Mass296.09
IUPAC Name2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCCc1nc(C)sc1CNC(=O)CN1CC(=O)NC1=O
InChIInChI=1S/C12H16N4O3S/c1-3-8-9(20-7(2)14-8)4-13-10(17)5-16-6-11(18)15-12(16)19/h3-6H2,1-2H3,(H,13,17)(H,15,18,19)
InChIKeyKSAVYVCCQVCIFP-UHFFFAOYSA-N
XLogP0.18
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 50.18
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-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide (CID 56721443) is 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide is CCc1nc(C)sc1CNC(=O)CN1CC(=O)NC1=O.
What is the InChIKey of 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The InChIKey is KSAVYVCCQVCIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O3S/c1-3-8-9(20-7(2)14-8)4-13-10(17)5-16-6-11(18)15-12(16)19/h3-6H2,1-2H3,(H,13,17)(H,15,18,19).
What are the key properties of 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide has a molecular weight of 296.35 g/mol, XLogP of 0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxoimidazolidin-1-yl)-N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 56721443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).