5-benzyl-5-butylimidazolidine-2,4-dione

C14H18N2O2 — CID 174713775

IUPAC5-benzyl-5-butylimidazolidine-2,4-dione
SMILESCCCCC1(Cc2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O2/c1-2-3-9-14(12(17)15-13(18)16-14)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H2,15,16,17,18)
InChIKeyRNQZDXJWVADHDD-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.00
Rot. Bonds5

About 5-benzyl-5-butylimidazolidine-2,4-dione

5-benzyl-5-butylimidazolidine-2,4-dione (PubChem CID 174713775) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-benzyl-5-butylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-benzyl-5-butylimidazolidine-2,4-dione
PubChem CID174713775
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name5-benzyl-5-butylimidazolidine-2,4-dione
SMILESCCCCC1(Cc2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C14H18N2O2/c1-2-3-9-14(12(17)15-13(18)16-14)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H2,15,16,17,18)
InChIKeyRNQZDXJWVADHDD-UHFFFAOYSA-N
XLogP2.00
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-[(4-methoxyphenyl)methyl]-5-propylimidazolidine-2,4-dione
CID 54342646
5-octyl-5-pentylimidazolidine-2,4-dione
CID 21324142
5-benzyl-5-ethyl-2-sulfanylideneimidazolidin-4-one
CID 82997586
3-benzyl-3-butylazetidine
CID 79451820
4,4-dibenzyl-1,3-oxazolidine-2,5-dione
CID 54213931
5-[[3,5-diamino-4-(4-methoxyphenoxy)phenyl]methyl]-5-propylimidazolidine-2,4-dione
CID 54478750
5-butyl-5-(naphthalen-1-ylmethyl)-1,3-diazinane-2,4,6-trione
CID 24834094
(6S)-6-benzyl-3-hexyl-3-(hydroxymethyl)piperazine-2,5-dione
CID 102422649
5,5-dibenzyl-1-heptyl-1,3-diazinane-2,4,6-trione
CID 11304322
4-(4-butyl-2,5-dioxoimidazolidin-4-yl)benzoic acid
CID 54049258
5-[[4-[2-[4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]phenyl]methyl]-5-pentylimidazolidine-2,4-dione
CID 91395948
5-ethoxy-5-phenylimidazolidine-2,4-dione
CID 139688617

Frequently Asked Questions

What is the IUPAC name of 5-benzyl-5-butylimidazolidine-2,4-dione?
The IUPAC name of 5-benzyl-5-butylimidazolidine-2,4-dione (CID 174713775) is 5-benzyl-5-butylimidazolidine-2,4-dione.
What is the SMILES notation for 5-benzyl-5-butylimidazolidine-2,4-dione?
The canonical SMILES for 5-benzyl-5-butylimidazolidine-2,4-dione is CCCCC1(Cc2ccccc2)NC(=O)NC1=O.
What is the InChIKey of 5-benzyl-5-butylimidazolidine-2,4-dione?
The InChIKey is RNQZDXJWVADHDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-2-3-9-14(12(17)15-13(18)16-14)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H2,15,16,17,18).
What are the key properties of 5-benzyl-5-butylimidazolidine-2,4-dione?
5-benzyl-5-butylimidazolidine-2,4-dione has a molecular weight of 246.31 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-5-butylimidazolidine-2,4-dione is sourced from PubChem (CID 174713775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).