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

C10H10F3N3O2S — CID 86783081

IUPAC(5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione
SMILESC[C@H]1NC(=O)N(CCc2nc(C(F)(F)F)cs2)C1=O
InChIInChI=1S/C10H10F3N3O2S/c1-5-8(17)16(9(18)14-5)3-2-7-15-6(4-19-7)10(11,12)13/h4-5H,2-3H2,1H3,(H,14,18)/t5-/m1/s1
InChIKeyGWJYQNXPVUVDRS-RXMQYKEDSA-N
MW293.27 g/mol
LogP1.64
Rot. Bonds3

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

(5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione (PubChem CID 86783081) has the molecular formula C10H10F3N3O2S and a molecular weight of 293.27 g/mol. Its IUPAC name is (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione
PubChem CID86783081
Molecular FormulaC10H10F3N3O2S
Molecular Weight293.27 g/mol
Exact Mass293.04
IUPAC Name(5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione
SMILESC[C@H]1NC(=O)N(CCc2nc(C(F)(F)F)cs2)C1=O
InChIInChI=1S/C10H10F3N3O2S/c1-5-8(17)16(9(18)14-5)3-2-7-15-6(4-19-7)10(11,12)13/h4-5H,2-3H2,1H3,(H,14,18)/t5-/m1/s1
InChIKeyGWJYQNXPVUVDRS-RXMQYKEDSA-N
XLogP1.64
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione (CID 86783081) is (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione is C[C@H]1NC(=O)N(CCc2nc(C(F)(F)F)cs2)C1=O.
What is the InChIKey of (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione?
The InChIKey is GWJYQNXPVUVDRS-RXMQYKEDSA-N. The full InChI is InChI=1S/C10H10F3N3O2S/c1-5-8(17)16(9(18)14-5)3-2-7-15-6(4-19-7)10(11,12)13/h4-5H,2-3H2,1H3,(H,14,18)/t5-/m1/s1.
What are the key properties of (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione?
(5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione has a molecular weight of 293.27 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 86783081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).