(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione

C19H23N3O3 — CID 97157390

IUPAC(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione
SMILESCC(C)c1ocnc1CN1C(=O)N[C@](C)(CCc2ccccc2)C1=O
InChIInChI=1S/C19H23N3O3/c1-13(2)16-15(20-12-25-16)11-22-17(23)19(3,21-18(22)24)10-9-14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3,(H,21,24)/t19-/m1/s1
InChIKeyOHFPVGLOEAJDIK-LJQANCHMSA-N
MW341.41 g/mol
LogP3.24
Rot. Bonds6

About (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione

(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione (PubChem CID 97157390) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione
PubChem CID97157390
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione
SMILESCC(C)c1ocnc1CN1C(=O)N[C@](C)(CCc2ccccc2)C1=O
InChIInChI=1S/C19H23N3O3/c1-13(2)16-15(20-12-25-16)11-22-17(23)19(3,21-18(22)24)10-9-14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3,(H,21,24)/t19-/m1/s1
InChIKeyOHFPVGLOEAJDIK-LJQANCHMSA-N
XLogP3.24
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.24
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-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione (CID 97157390) is (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione is CC(C)c1ocnc1CN1C(=O)N[C@](C)(CCc2ccccc2)C1=O.
What is the InChIKey of (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione?
The InChIKey is OHFPVGLOEAJDIK-LJQANCHMSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13(2)16-15(20-12-25-16)11-22-17(23)19(3,21-18(22)24)10-9-14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3,(H,21,24)/t19-/m1/s1.
What are the key properties of (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione?
(5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione has a molecular weight of 341.41 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-5-(2-phenylethyl)-3-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 97157390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).