(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione

C14H15N3O4S — CID 94139825

IUPAC(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione
SMILESCc1csc(=O)n1CCN1C(=O)N[C@](C)(c2ccco2)C1=O
InChIInChI=1S/C14H15N3O4S/c1-9-8-22-13(20)16(9)5-6-17-11(18)14(2,15-12(17)19)10-4-3-7-21-10/h3-4,7-8H,5-6H2,1-2H3,(H,15,19)/t14-/m1/s1
InChIKeyVTWIGSGZRGFCAK-CQSZACIVSA-N
MW321.36 g/mol
LogP1.28
Rot. Bonds4

About (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione

(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione (PubChem CID 94139825) has the molecular formula C14H15N3O4S and a molecular weight of 321.36 g/mol. Its IUPAC name is (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione
PubChem CID94139825
Molecular FormulaC14H15N3O4S
Molecular Weight321.36 g/mol
Exact Mass321.08
IUPAC Name(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione
SMILESCc1csc(=O)n1CCN1C(=O)N[C@](C)(c2ccco2)C1=O
InChIInChI=1S/C14H15N3O4S/c1-9-8-22-13(20)16(9)5-6-17-11(18)14(2,15-12(17)19)10-4-3-7-21-10/h3-4,7-8H,5-6H2,1-2H3,(H,15,19)/t14-/m1/s1
InChIKeyVTWIGSGZRGFCAK-CQSZACIVSA-N
XLogP1.28
TPSA84.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.36
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-(furan-2-yl)-5-methyl-3-[2-(4-methylphenoxy)ethyl]imidazolidine-2,4-dione
CID 46640128
(5R)-3-benzyl-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51462112
3-(2-aminopropyl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 18073152
(5S)-5-(furan-2-yl)-3-[2-(2-methoxyphenoxy)ethyl]-5-methylimidazolidine-2,4-dione
CID 94498941
3-[2-(4-chlorophenoxy)ethyl]-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51249961
5-(furan-2-yl)-5-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]imidazolidine-2,4-dione
CID 46642091
5-(furan-2-yl)-5-methyl-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]imidazolidine-2,4-dione
CID 47013283
5-(furan-2-yl)-5-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione
CID 51249918
5-(furan-2-yl)-5-methyl-3-[2-(2-methyl-3-pyridinyl)-2-oxoethyl]imidazolidine-2,4-dione
CID 122149444
3-[2-(2,4-dimethylphenyl)-2-oxoethyl]-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51259022
tert-butyl 2-[4-(furan-2-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetate
CID 51259018
3-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51116154

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione (CID 94139825) is (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione is Cc1csc(=O)n1CCN1C(=O)N[C@](C)(c2ccco2)C1=O.
What is the InChIKey of (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione?
The InChIKey is VTWIGSGZRGFCAK-CQSZACIVSA-N. The full InChI is InChI=1S/C14H15N3O4S/c1-9-8-22-13(20)16(9)5-6-17-11(18)14(2,15-12(17)19)10-4-3-7-21-10/h3-4,7-8H,5-6H2,1-2H3,(H,15,19)/t14-/m1/s1.
What are the key properties of (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione?
(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione has a molecular weight of 321.36 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 94139825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).