(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one

C19H22N2O3 — CID 789461

IUPAC(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one
SMILESCCN1C(=O)N(CC)[C@](O)(c2ccccc2)[C@@]1(O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-20-17(22)21(4-2)19(24,16-13-9-6-10-14-16)18(20,23)15-11-7-5-8-12-15/h5-14,23-24H,3-4H2,1-2H3/t18-,19-/m0/s1
InChIKeyMBBSWOGYGKCKIE-OALUTQOASA-N
MW326.40 g/mol
LogP2.45
Rot. Bonds4

About (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one

(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one (PubChem CID 789461) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one.

Molecular Properties

Compound Name(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one
PubChem CID789461
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one
SMILESCCN1C(=O)N(CC)[C@](O)(c2ccccc2)[C@@]1(O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-20-17(22)21(4-2)19(24,16-13-9-6-10-14-16)18(20,23)15-11-7-5-8-12-15/h5-14,23-24H,3-4H2,1-2H3/t18-,19-/m0/s1
InChIKeyMBBSWOGYGKCKIE-OALUTQOASA-N
XLogP2.45
TPSA64.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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(4R,5S)-1,3-dibutyl-5-hydroxy-1'-methyl-5-phenylspiro[imidazolidine-4,3'-indole]-2,2'-dione
CID 102480435
1-benzyl-3,3-dichloro-5-hydroxy-4,4-dimethyl-5-phenylpyrrolidin-2-one
CID 134847338
4-hydroxy-5,5-dimethyl-3,4-diphenyl-1,3-oxazolidin-2-one
CID 12654053
1-ethyl-3,3,6-trimethyl-6-phenylpiperazine-2,5-dione
CID 64902778
2-butyl-3-hydroxy-3-phenylisoindol-1-one
CID 4086644
1,3-diethyl-3,6-dimethyl-6-phenylpiperazine-2,5-dione
CID 64885693
2-ethyl-3-(ethylamino)-3-phenylisoindol-1-one
CID 170908629
1-ethyl-5-hydroxy-4,4-diphenylimidazolidin-2-one
CID 135293152
1-ethyl-3,3-diphenylpiperidin-4-one
CID 13440408
2-(diethylamino)-3-hydroxy-3-phenylisoindol-1-one
CID 5121880
(3S)-3-hydroxy-3-phenyl-2-(trimethylsilylmethyl)isoindol-1-one
CID 124628887

Frequently Asked Questions

What is the IUPAC name of (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one?
The IUPAC name of (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one (CID 789461) is (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one.
What is the SMILES notation for (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one?
The canonical SMILES for (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one is CCN1C(=O)N(CC)[C@](O)(c2ccccc2)[C@@]1(O)c1ccccc1.
What is the InChIKey of (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one?
The InChIKey is MBBSWOGYGKCKIE-OALUTQOASA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-20-17(22)21(4-2)19(24,16-13-9-6-10-14-16)18(20,23)15-11-7-5-8-12-15/h5-14,23-24H,3-4H2,1-2H3/t18-,19-/m0/s1.
What are the key properties of (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one?
(4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one has a molecular weight of 326.40 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-1,3-diethyl-4,5-dihydroxy-4,5-diphenylimidazolidin-2-one is sourced from PubChem (CID 789461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).