1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione

C16H22N2O2 — CID 18338637

IUPAC1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)CN1C(=O)N(C(C)C)C(=O)C1c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-11(2)10-17-14(13-8-6-5-7-9-13)15(19)18(12(3)4)16(17)20/h5-9,11-12,14H,10H2,1-4H3
InChIKeyCLZKCFOYPDSCBS-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.06
Rot. Bonds4

About 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione

1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione (PubChem CID 18338637) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione
PubChem CID18338637
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)CN1C(=O)N(C(C)C)C(=O)C1c1ccccc1
InChIInChI=1S/C16H22N2O2/c1-11(2)10-17-14(13-8-6-5-7-9-13)15(19)18(12(3)4)16(17)20/h5-9,11-12,14H,10H2,1-4H3
InChIKeyCLZKCFOYPDSCBS-UHFFFAOYSA-N
XLogP3.06
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-phenyl-1,3-di(propan-2-yl)imidazolidine-2,4-dione
CID 134305318
3-(2-methylpropyl)-2-phenyl-5-propan-2-ylimidazolidin-4-one
CID 83242661
2,3-bis(2-methylpropyl)-5-phenylimidazolidin-4-one
CID 83243088
(2R,3S)-1-(2-methylpropyl)-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
CID 94217785
2-[(6S)-2,4-dioxo-6-phenyl-3-propan-2-yl-1,3-diazinan-1-yl]acetic acid
CID 59370448
5-benzyl-2-methyl-4-phenyl-1,2,5-oxadiazinane-3,6-dione
CID 101385697
3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
CID 84571226
N-fluoro-N-[1-(2-methylpropyl)-2-oxo-5-phenylpyrrolidin-3-yl]acetamide
CID 174528371
1-tert-butyl-6-phenyl-3-propan-2-ylpiperazine-2,5-dione
CID 64955154
(3aR,4S,8aS)-3-(4-fluorophenyl)-1-(2-methylpropyl)-4-phenyl-4,5,6,7,8,8a-hexahydro-3aH-cyclohepta[d]imidazol-2-one
CID 155985816
6-phenyl-3-propan-2-yl-1,3-diazinane-2,4-dione
CID 59370437
(4E)-5-(4-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(2-methylpropyl)pyrrolidine-2,3-dione
CID 6253435

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione (CID 18338637) is 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione is CC(C)CN1C(=O)N(C(C)C)C(=O)C1c1ccccc1.
What is the InChIKey of 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is CLZKCFOYPDSCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-11(2)10-17-14(13-8-6-5-7-9-13)15(19)18(12(3)4)16(17)20/h5-9,11-12,14H,10H2,1-4H3.
What are the key properties of 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione?
1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 274.36 g/mol, XLogP of 3.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-5-phenyl-3-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 18338637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).