5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one

C20H20F2N2O2 — CID 146603620

IUPAC5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one
SMILESCOc1ccc(C2(c3cc(C)c(F)cc3F)N=C(C)N(C)C2=O)cc1C
InChIInChI=1S/C20H20F2N2O2/c1-11-9-15(17(22)10-16(11)21)20(19(25)24(4)13(3)23-20)14-6-7-18(26-5)12(2)8-14/h6-10H,1-5H3
InChIKeyYWOFFXNGGQWHJO-UHFFFAOYSA-N
MW358.39 g/mol
LogP3.72
Rot. Bonds3

About 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one

5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one (PubChem CID 146603620) has the molecular formula C20H20F2N2O2 and a molecular weight of 358.39 g/mol. Its IUPAC name is 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one.

Molecular Properties

Compound Name5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one
PubChem CID146603620
Molecular FormulaC20H20F2N2O2
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one
SMILESCOc1ccc(C2(c3cc(C)c(F)cc3F)N=C(C)N(C)C2=O)cc1C
InChIInChI=1S/C20H20F2N2O2/c1-11-9-15(17(22)10-16(11)21)20(19(25)24(4)13(3)23-20)14-6-7-18(26-5)12(2)8-14/h6-10H,1-5H3
InChIKeyYWOFFXNGGQWHJO-UHFFFAOYSA-N
XLogP3.72
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one?
The IUPAC name of 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one (CID 146603620) is 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one.
What is the SMILES notation for 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one?
The canonical SMILES for 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one is COc1ccc(C2(c3cc(C)c(F)cc3F)N=C(C)N(C)C2=O)cc1C.
What is the InChIKey of 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one?
The InChIKey is YWOFFXNGGQWHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N2O2/c1-11-9-15(17(22)10-16(11)21)20(19(25)24(4)13(3)23-20)14-6-7-18(26-5)12(2)8-14/h6-10H,1-5H3.
What are the key properties of 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one?
5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one has a molecular weight of 358.39 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-difluoro-5-methylphenyl)-5-(4-methoxy-3-methylphenyl)-2,3-dimethylimidazol-4-one is sourced from PubChem (CID 146603620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).