5-(cyclohexylmethyl)imidazole-2,4-dione

C10H14N2O2 — CID 141042921

IUPAC5-(cyclohexylmethyl)imidazole-2,4-dione
SMILESO=C1N=C(CC2CCCCC2)C(=O)N1
InChIInChI=1S/C10H14N2O2/c13-9-8(11-10(14)12-9)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13,14)
InChIKeyNCYHCTKYEWEPBT-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.65
Rot. Bonds2

About 5-(cyclohexylmethyl)imidazole-2,4-dione

5-(cyclohexylmethyl)imidazole-2,4-dione (PubChem CID 141042921) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 5-(cyclohexylmethyl)imidazole-2,4-dione.

Molecular Properties

Compound Name5-(cyclohexylmethyl)imidazole-2,4-dione
PubChem CID141042921
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name5-(cyclohexylmethyl)imidazole-2,4-dione
SMILESO=C1N=C(CC2CCCCC2)C(=O)N1
InChIInChI=1S/C10H14N2O2/c13-9-8(11-10(14)12-9)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13,14)
InChIKeyNCYHCTKYEWEPBT-UHFFFAOYSA-N
XLogP1.65
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylmethyl)imidazole-2,4-dione?
The IUPAC name of 5-(cyclohexylmethyl)imidazole-2,4-dione (CID 141042921) is 5-(cyclohexylmethyl)imidazole-2,4-dione.
What is the SMILES notation for 5-(cyclohexylmethyl)imidazole-2,4-dione?
The canonical SMILES for 5-(cyclohexylmethyl)imidazole-2,4-dione is O=C1N=C(CC2CCCCC2)C(=O)N1.
What is the InChIKey of 5-(cyclohexylmethyl)imidazole-2,4-dione?
The InChIKey is NCYHCTKYEWEPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c13-9-8(11-10(14)12-9)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13,14).
What are the key properties of 5-(cyclohexylmethyl)imidazole-2,4-dione?
5-(cyclohexylmethyl)imidazole-2,4-dione has a molecular weight of 194.23 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylmethyl)imidazole-2,4-dione is sourced from PubChem (CID 141042921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).