(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one

C20H19N3O2 — CID 101458706

IUPAC(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one
SMILESC[C@H]1[C@@H](c2ccccc2)N(c2cc(-c3ccccc3)no2)C(=O)N1C
InChIInChI=1S/C20H19N3O2/c1-14-19(16-11-7-4-8-12-16)23(20(24)22(14)2)18-13-17(21-25-18)15-9-5-3-6-10-15/h3-14,19H,1-2H3/t14-,19-/m0/s1
InChIKeyWSZNZHHOIHGOTQ-LIRRHRJNSA-N
MW333.39 g/mol
LogP4.34
Rot. Bonds3

About (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one

(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one (PubChem CID 101458706) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one.

Molecular Properties

Compound Name(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one
PubChem CID101458706
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one
SMILESC[C@H]1[C@@H](c2ccccc2)N(c2cc(-c3ccccc3)no2)C(=O)N1C
InChIInChI=1S/C20H19N3O2/c1-14-19(16-11-7-4-8-12-16)23(20(24)22(14)2)18-13-17(21-25-18)15-9-5-3-6-10-15/h3-14,19H,1-2H3/t14-,19-/m0/s1
InChIKeyWSZNZHHOIHGOTQ-LIRRHRJNSA-N
XLogP4.34
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The IUPAC name of (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one (CID 101458706) is (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one.
What is the SMILES notation for (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The canonical SMILES for (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one is C[C@H]1[C@@H](c2ccccc2)N(c2cc(-c3ccccc3)no2)C(=O)N1C.
What is the InChIKey of (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The InChIKey is WSZNZHHOIHGOTQ-LIRRHRJNSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-14-19(16-11-7-4-8-12-16)23(20(24)22(14)2)18-13-17(21-25-18)15-9-5-3-6-10-15/h3-14,19H,1-2H3/t14-,19-/m0/s1.
What are the key properties of (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one?
(4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one has a molecular weight of 333.39 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-1,5-dimethyl-4-phenyl-3-(3-phenyl-1,2-oxazol-5-yl)imidazolidin-2-one is sourced from PubChem (CID 101458706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).