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

C16H15FN4O3S — CID 2461966

IUPAC2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide
SMILESCC1(C)NC(=O)N(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)C1=O
InChIInChI=1S/C16H15FN4O3S/c1-16(2)13(23)21(15(24)20-16)7-12(22)19-14-18-11(8-25-14)9-3-5-10(17)6-4-9/h3-6,8H,7H2,1-2H3,(H,20,24)(H,18,19,22)
InChIKeyZHSAYPAWIHIVJD-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.22
Rot. Bonds4

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

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 2461966) has the molecular formula C16H15FN4O3S and a molecular weight of 362.39 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide
PubChem CID2461966
Molecular FormulaC16H15FN4O3S
Molecular Weight362.39 g/mol
Exact Mass362.08
IUPAC Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide
SMILESCC1(C)NC(=O)N(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)C1=O
InChIInChI=1S/C16H15FN4O3S/c1-16(2)13(23)21(15(24)20-16)7-12(22)19-14-18-11(8-25-14)9-3-5-10(17)6-4-9/h3-6,8H,7H2,1-2H3,(H,20,24)(H,18,19,22)
InChIKeyZHSAYPAWIHIVJD-UHFFFAOYSA-N
XLogP2.22
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.22
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-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide (CID 2461966) is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide is CC1(C)NC(=O)N(CC(=O)Nc2nc(-c3ccc(F)cc3)cs2)C1=O.
What is the InChIKey of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is ZHSAYPAWIHIVJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN4O3S/c1-16(2)13(23)21(15(24)20-16)7-12(22)19-14-18-11(8-25-14)9-3-5-10(17)6-4-9/h3-6,8H,7H2,1-2H3,(H,20,24)(H,18,19,22).
What are the key properties of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide?
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 362.39 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 2461966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).