(5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione

C15H23N5O3 — CID 95780978

About (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione

(5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione (PubChem CID 95780978) has the molecular formula C15H23N5O3 and a molecular weight of 321.38 g/mol. Its IUPAC name is (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione
• PubChem CID: 95780978
• Molecular Formula: C15H23N5O3
• Molecular Weight: 321.38 g/mol
• Exact Mass: 321.18
• IUPAC Name: (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione
• SMILES: CC(C)c1nc(CN2CCC[C@H]([C@@]3(C)NC(=O)NC3=O)C2)no1
• InChI: InChI=1S/C15H23N5O3/c1-9(2)12-16-11(19-23-12)8-20-6-4-5-10(7-20)15(3)13(21)17-14(22)18-15/h9-10H,4-8H2,1-3H3,(H2,17,18,21,22)/t10-,15+/m0/s1
• InChIKey: RDOKDFDEQPEHAQ-ZUZCIYMTSA-N
• XLogP: 1.00
• TPSA: 100.36 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	321.38
LogP ≤ 5	1.00
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione?

The IUPAC name of (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione (CID 95780978) is (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione.

What is the SMILES notation for (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione?

The canonical SMILES for (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione is CC(C)c1nc(CN2CCC[C@H]([C@@]3(C)NC(=O)NC3=O)C2)no1.

What is the InChIKey of (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione?

The InChIKey is RDOKDFDEQPEHAQ-ZUZCIYMTSA-N. The full InChI is InChI=1S/C15H23N5O3/c1-9(2)12-16-11(19-23-12)8-20-6-4-5-10(7-20)15(3)13(21)17-14(22)18-15/h9-10H,4-8H2,1-3H3,(H2,17,18,21,22)/t10-,15+/m0/s1.

What are the key properties of (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione?

(5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione has a molecular weight of 321.38 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-5-methyl-5-[(3S)-1-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 95780978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).