(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione

C19H26FN3O2 — CID 95216753

IUPAC(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione
SMILESO=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1CCF
InChIInChI=1S/C19H26FN3O2/c20-11-14-23-17(24)19(22-18(23)25,16-8-12-21-13-9-16)10-4-7-15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,22,25)/t19-/m1/s1
InChIKeyRGAGKTKOONFZNI-LJQANCHMSA-N
MW347.43 g/mol
LogP2.27
Rot. Bonds7

About (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione

(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione (PubChem CID 95216753) has the molecular formula C19H26FN3O2 and a molecular weight of 347.43 g/mol. Its IUPAC name is (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione
PubChem CID95216753
Molecular FormulaC19H26FN3O2
Molecular Weight347.43 g/mol
Exact Mass347.20
IUPAC Name(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione
SMILESO=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1CCF
InChIInChI=1S/C19H26FN3O2/c20-11-14-23-17(24)19(22-18(23)25,16-8-12-21-13-9-16)10-4-7-15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,22,25)/t19-/m1/s1
InChIKeyRGAGKTKOONFZNI-LJQANCHMSA-N
XLogP2.27
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 52.27
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

(5S)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione
CID 95216752
(5R)-3-(3-hydroxypropyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione
CID 95202564
5-(3-phenylpropyl)-5-piperidin-4-yl-3-(2-pyrazol-1-ylethyl)imidazolidine-2,4-dione;hydrochloride
CID 154885329
3-(cyclopropylmethyl)-5-(2-phenylethyl)-5-piperidin-4-ylimidazolidine-2,4-dione
CID 56720812
(5R)-5-(2-phenylethyl)-5-piperidin-4-yl-3-(pyridin-3-ylmethyl)imidazolidine-2,4-dione
CID 95221358
3-but-2-ynyl-5-(2-phenylethyl)-5-piperidin-4-ylimidazolidine-2,4-dione
CID 118760432
(5R)-3-(4-fluorobutyl)-5-piperidin-4-yl-5-propylimidazolidine-2,4-dione
CID 95219594
(5S)-3-cyclopentyl-5-(2-phenylethyl)-5-piperidin-4-ylimidazolidine-2,4-dione
CID 95209787
5-(2-phenylethyl)-5-piperidin-4-yl-3-(pyrazin-2-ylmethyl)imidazolidine-2,4-dione
CID 56710057
4-[2-[(4R)-2,5-dioxo-4-piperidin-4-yl-4-propylimidazolidin-1-yl]ethyl]benzonitrile
CID 95223916
(5R)-5-benzyl-3-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-5-piperidin-4-ylimidazolidine-2,4-dione
CID 95220360
5-[(4-fluorophenyl)methyl]-5-piperidin-4-yl-3-(2-pyridin-2-ylethyl)imidazolidine-2,4-dione
CID 56714637

Frequently Asked Questions

What is the IUPAC name of (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione?
The IUPAC name of (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione (CID 95216753) is (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione?
The canonical SMILES for (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione is O=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1CCF.
What is the InChIKey of (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione?
The InChIKey is RGAGKTKOONFZNI-LJQANCHMSA-N. The full InChI is InChI=1S/C19H26FN3O2/c20-11-14-23-17(24)19(22-18(23)25,16-8-12-21-13-9-16)10-4-7-15-5-2-1-3-6-15/h1-3,5-6,16,21H,4,7-14H2,(H,22,25)/t19-/m1/s1.
What are the key properties of (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione?
(5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione has a molecular weight of 347.43 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-(2-fluoroethyl)-5-(3-phenylpropyl)-5-piperidin-4-ylimidazolidine-2,4-dione is sourced from PubChem (CID 95216753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).