5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione

C19H22N4O5 — CID 51132909

IUPAC5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
SMILESCC1(c2cccc(N3CCOC3=O)c2)NC(=O)N(CC(=O)N2CCCC2)C1=O
InChIInChI=1S/C19H22N4O5/c1-19(13-5-4-6-14(11-13)22-9-10-28-18(22)27)16(25)23(17(26)20-19)12-15(24)21-7-2-3-8-21/h4-6,11H,2-3,7-10,12H2,1H3,(H,20,26)
InChIKeyVCILCZUWYBIOQX-UHFFFAOYSA-N
MW386.41 g/mol
LogP1.03
Rot. Bonds4

About 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione

5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione (PubChem CID 51132909) has the molecular formula C19H22N4O5 and a molecular weight of 386.41 g/mol. Its IUPAC name is 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
PubChem CID51132909
Molecular FormulaC19H22N4O5
Molecular Weight386.41 g/mol
Exact Mass386.16
IUPAC Name5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
SMILESCC1(c2cccc(N3CCOC3=O)c2)NC(=O)N(CC(=O)N2CCCC2)C1=O
InChIInChI=1S/C19H22N4O5/c1-19(13-5-4-6-14(11-13)22-9-10-28-18(22)27)16(25)23(17(26)20-19)12-15(24)21-7-2-3-8-21/h4-6,11H,2-3,7-10,12H2,1H3,(H,20,26)
InChIKeyVCILCZUWYBIOQX-UHFFFAOYSA-N
XLogP1.03
TPSA99.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(5R)-3-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]imidazolidine-2,4-dione
CID 52909883
5-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenylimidazolidine-2,4-dione
CID 3874337
(5R)-5-(3-bromophenyl)-5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
CID 2702011
(5S)-5-(3-bromophenyl)-5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
CID 2702012
(5R)-3-[2-(azepan-1-yl)-2-oxoethyl]-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 2526606
(5S)-5-(2,3-dihydro-1H-inden-5-yl)-5-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
CID 8011147
3-[(4S)-4-methyl-1-(2-morpholin-4-yl-2-oxoethyl)-2,5-dioxoimidazolidin-4-yl]benzonitrile
CID 94797847
(5R)-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
CID 7595171
3-[2-(azocan-1-yl)-2-oxoethyl]-5-(4-chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 51215204
3-[2-(azetidin-1-yl)-2-oxoethyl]-5-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
CID 51334274
(2-oxo-2-piperidin-1-ylethyl) 2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetate
CID 7709372
(5R)-5-(3,4-dichlorophenyl)-5-methyl-3-(2-morpholin-4-yl-2-oxoethyl)imidazolidine-2,4-dione
CID 27029661

Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione (CID 51132909) is 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione is CC1(c2cccc(N3CCOC3=O)c2)NC(=O)N(CC(=O)N2CCCC2)C1=O.
What is the InChIKey of 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione?
The InChIKey is VCILCZUWYBIOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O5/c1-19(13-5-4-6-14(11-13)22-9-10-28-18(22)27)16(25)23(17(26)20-19)12-15(24)21-7-2-3-8-21/h4-6,11H,2-3,7-10,12H2,1H3,(H,20,26).
What are the key properties of 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione?
5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione has a molecular weight of 386.41 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 51132909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).