(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione

C14H17N3O2 — CID 94754129

IUPAC(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione
SMILESO=C1N[C@@H](c2ccccc2)C(=O)N1C1CCNCC1
InChIInChI=1S/C14H17N3O2/c18-13-12(10-4-2-1-3-5-10)16-14(19)17(13)11-6-8-15-9-7-11/h1-5,11-12,15H,6-9H2,(H,16,19)/t12-/m0/s1
InChIKeyGBZSRUXXRAAMCR-LBPRGKRZSA-N
MW259.31 g/mol
LogP1.03
Rot. Bonds2

About (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione

(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione (PubChem CID 94754129) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione
PubChem CID94754129
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione
SMILESO=C1N[C@@H](c2ccccc2)C(=O)N1C1CCNCC1
InChIInChI=1S/C14H17N3O2/c18-13-12(10-4-2-1-3-5-10)16-14(19)17(13)11-6-8-15-9-7-11/h1-5,11-12,15H,6-9H2,(H,16,19)/t12-/m0/s1
InChIKeyGBZSRUXXRAAMCR-LBPRGKRZSA-N
XLogP1.03
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-phenyl-1-piperidin-4-yl-3,4-dihydroquinazolin-2-one
CID 19423615
3-(1-methylpiperidin-4-yl)-5-phenylimidazolidine-2,4-dione
CID 84571197
4-(2-phenylazetidin-1-yl)piperidine
CID 59511179
4-phenyl-1-piperidin-4-yl-4H-3,1-benzoxazin-2-one
CID 22914652
2-phenyl-1-piperidin-4-ylazetidine-3-carboxamide
CID 90013485
5-phenyl-1-piperidin-4-yl-1,2,4-triazolidin-3-one;hydrochloride
CID 67171133
3-amino-1-piperidin-4-yl-3H-indol-2-one
CID 174586562
1-piperidin-4-yl-4H-3,1-benzoxazin-2-one
CID 10704740
2-piperidin-4-ylbenzo[de]isoquinoline-1,3-dione
CID 61348625
3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
CID 84571226
3-ethyl-5-phenylimidazolidine-2,4-dione
CID 3292
6-phenyl-4-piperidin-4-yl-1,4-diazepane-2,5-dione;hydrochloride
CID 75365682

Frequently Asked Questions

What is the IUPAC name of (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione (CID 94754129) is (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione is O=C1N[C@@H](c2ccccc2)C(=O)N1C1CCNCC1.
What is the InChIKey of (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione?
The InChIKey is GBZSRUXXRAAMCR-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H17N3O2/c18-13-12(10-4-2-1-3-5-10)16-14(19)17(13)11-6-8-15-9-7-11/h1-5,11-12,15H,6-9H2,(H,16,19)/t12-/m0/s1.
What are the key properties of (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione?
(5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione has a molecular weight of 259.31 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-phenyl-3-piperidin-4-ylimidazolidine-2,4-dione is sourced from PubChem (CID 94754129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).