(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione

C13H18N4O2 — CID 15120613

IUPAC(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1N[C@H](Cc2cnc[nH]2)C(=O)N1C1CCCCC1
InChIInChI=1S/C13H18N4O2/c18-12-11(6-9-7-14-8-15-9)16-13(19)17(12)10-4-2-1-3-5-10/h7-8,10-11H,1-6H2,(H,14,15)(H,16,19)/t11-/m1/s1
InChIKeyUYYLTQJJCPIFRN-LLVKDONJSA-N
MW262.31 g/mol
LogP1.21
Rot. Bonds3

About (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione

(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione (PubChem CID 15120613) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione
PubChem CID15120613
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1N[C@H](Cc2cnc[nH]2)C(=O)N1C1CCCCC1
InChIInChI=1S/C13H18N4O2/c18-12-11(6-9-7-14-8-15-9)16-13(19)17(12)10-4-2-1-3-5-10/h7-8,10-11H,1-6H2,(H,14,15)(H,16,19)/t11-/m1/s1
InChIKeyUYYLTQJJCPIFRN-LLVKDONJSA-N
XLogP1.21
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione (CID 15120613) is (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione is O=C1N[C@H](Cc2cnc[nH]2)C(=O)N1C1CCCCC1.
What is the InChIKey of (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is UYYLTQJJCPIFRN-LLVKDONJSA-N. The full InChI is InChI=1S/C13H18N4O2/c18-12-11(6-9-7-14-8-15-9)16-13(19)17(12)10-4-2-1-3-5-10/h7-8,10-11H,1-6H2,(H,14,15)(H,16,19)/t11-/m1/s1.
What are the key properties of (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione?
(5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 262.31 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-cyclohexyl-5-(1H-imidazol-5-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 15120613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).