3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone

C12H11N2OSe — CID 6435386

IUPAC—
SMILESCc1ccc(/C=C2\N=C([Se])N(C)C2=O)cc1
InChIInChI=1S/C12H11N2OSe/c1-8-3-5-9(6-4-8)7-10-11(15)14(2)12(16)13-10/h3-7H,1-2H3/b10-7-
InChIKeyUTLJOFQEARJCID-YFHOEESVSA-N
MW278.19 g/mol
LogP1.33
Rot. Bonds1

About 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone

3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone (PubChem CID 6435386) has the molecular formula C12H11N2OSe and a molecular weight of 278.19 g/mol.

Molecular Properties

Compound Name3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone
PubChem CID6435386
Molecular FormulaC12H11N2OSe
Molecular Weight278.19 g/mol
Exact Mass279.00
IUPAC Name—
SMILESCc1ccc(/C=C2\N=C([Se])N(C)C2=O)cc1
InChIInChI=1S/C12H11N2OSe/c1-8-3-5-9(6-4-8)7-10-11(15)14(2)12(16)13-10/h3-7H,1-2H3/b10-7-
InChIKeyUTLJOFQEARJCID-YFHOEESVSA-N
XLogP1.33
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.19
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone?
The IUPAC name of 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone (CID 6435386) is not available.
What is the SMILES notation for 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone?
The canonical SMILES for 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone is Cc1ccc(/C=C2\N=C([Se])N(C)C2=O)cc1.
What is the InChIKey of 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone?
The InChIKey is UTLJOFQEARJCID-YFHOEESVSA-N. The full InChI is InChI=1S/C12H11N2OSe/c1-8-3-5-9(6-4-8)7-10-11(15)14(2)12(16)13-10/h3-7H,1-2H3/b10-7-.
What are the key properties of 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone?
3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone has a molecular weight of 278.19 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Methyl-5-((4-methylphenyl)methylene)-2-selenoxo-4-imidazolidinone is sourced from PubChem (CID 6435386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).