3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium

C17H20F3N4O4SY- — CID 59973707

IUPAC3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium
SMILESCN1C(=O)OC(CC(F)(F)F)C1C(=O)NC(Cc1cscn1)C(=O)N1[CH-]CCC1.[Y]
InChIInChI=1S/C17H20F3N4O4S.Y/c1-23-13(12(28-16(23)27)7-17(18,19)20)14(25)22-11(6-10-8-29-9-21-10)15(26)24-4-2-3-5-24;/h4,8-9,11-13H,2-3,5-7H2,1H3,(H,22,25);/q-1;
InChIKeyBIVOKKDYMVJSSZ-UHFFFAOYSA-N
MW522.34 g/mol
LogP1.72
Rot. Bonds6

About 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium

3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium (PubChem CID 59973707) has the molecular formula C17H20F3N4O4SY- and a molecular weight of 522.34 g/mol. Its IUPAC name is 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium.

Molecular Properties

Compound Name3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium
PubChem CID59973707
Molecular FormulaC17H20F3N4O4SY-
Molecular Weight522.34 g/mol
Exact Mass522.02
IUPAC Name3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium
SMILESCN1C(=O)OC(CC(F)(F)F)C1C(=O)NC(Cc1cscn1)C(=O)N1[CH-]CCC1.[Y]
InChIInChI=1S/C17H20F3N4O4S.Y/c1-23-13(12(28-16(23)27)7-17(18,19)20)14(25)22-11(6-10-8-29-9-21-10)15(26)24-4-2-3-5-24;/h4,8-9,11-13H,2-3,5-7H2,1H3,(H,22,25);/q-1;
InChIKeyBIVOKKDYMVJSSZ-UHFFFAOYSA-N
XLogP1.72
TPSA91.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500522.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium?
The IUPAC name of 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium (CID 59973707) is 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium.
What is the SMILES notation for 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium?
The canonical SMILES for 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium is CN1C(=O)OC(CC(F)(F)F)C1C(=O)NC(Cc1cscn1)C(=O)N1[CH-]CCC1.[Y].
What is the InChIKey of 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium?
The InChIKey is BIVOKKDYMVJSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20F3N4O4S.Y/c1-23-13(12(28-16(23)27)7-17(18,19)20)14(25)22-11(6-10-8-29-9-21-10)15(26)24-4-2-3-5-24;/h4,8-9,11-13H,2-3,5-7H2,1H3,(H,22,25);/q-1;.
What are the key properties of 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium?
3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium has a molecular weight of 522.34 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-oxo-N-[1-oxo-1-pyrrolidin-5-id-1-yl-3-(1,3-thiazol-4-yl)propan-2-yl]-5-(2,2,2-trifluoroethyl)-1,3-oxazolidine-4-carboxamide;yttrium is sourced from PubChem (CID 59973707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).