4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one

C10H10ClFN2O — CID 116855884

IUPAC4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one
SMILESCc1cc(Cl)c(C2CNC(=O)N2)cc1F
InChIInChI=1S/C10H10ClFN2O/c1-5-2-7(11)6(3-8(5)12)9-4-13-10(15)14-9/h2-3,9H,4H2,1H3,(H2,13,14,15)
InChIKeyIBQVEXIQAWUEGO-UHFFFAOYSA-N
MW228.65 g/mol
LogP2.14
Rot. Bonds1

About 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one

4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one (PubChem CID 116855884) has the molecular formula C10H10ClFN2O and a molecular weight of 228.65 g/mol. Its IUPAC name is 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one
PubChem CID116855884
Molecular FormulaC10H10ClFN2O
Molecular Weight228.65 g/mol
Exact Mass228.05
IUPAC Name4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one
SMILESCc1cc(Cl)c(C2CNC(=O)N2)cc1F
InChIInChI=1S/C10H10ClFN2O/c1-5-2-7(11)6(3-8(5)12)9-4-13-10(15)14-9/h2-3,9H,4H2,1H3,(H2,13,14,15)
InChIKeyIBQVEXIQAWUEGO-UHFFFAOYSA-N
XLogP2.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.65
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-Chlorobenzyl)imidazolidin-2-one
CID 3235606
US10343992, Example 137
CID 134363680
5-(2-Chlorophenyl)-1-methyl-4,5-dihydro-1H-imidazol-2-ol
CID 57452
1-[(2-Chloro-6-fluorophenyl)methyl]-3-methylurea
CID 2804468
(4S)-N-[(2-chloro-4-fluorophenyl)methyl]-1-methyl-2-oxoimidazolidine-4-carboxamide
CID 71454395
(4S)-N-[(2-chloro-4-fluorophenyl)methyl]-3-methyl-2-oxoimidazolidine-4-carboxamide
CID 71459859
(4S)-N-[(2-chloro-4-fluorophenyl)methyl]-3-ethyl-2-oxoimidazolidine-4-carboxamide
CID 71461565
(4S)-N-[(2-chloro-4-fluorophenyl)methyl]-1,3-dimethyl-2-oxoimidazolidine-4-carboxamide
CID 71463306
5-(4-Chlorophenyl)-1-methyl-4,5-dihydro-1H-imidazol-2-ol
CID 60459
1-[(2-Chloro-6-fluorophenyl)methyl]-3-propan-2-ylurea
CID 2804469
1-[1-(3-Chlorophenyl)ethyl]-3-cyclopentylurea
CID 42924600
1-(2-(2-Chlorophenyl)-2-(dimethylamino)ethyl)-3-(4-fluorobenzyl)urea
CID 45504539

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one?
The IUPAC name of 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one (CID 116855884) is 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one.
What is the SMILES notation for 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one?
The canonical SMILES for 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one is Cc1cc(Cl)c(C2CNC(=O)N2)cc1F.
What is the InChIKey of 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one?
The InChIKey is IBQVEXIQAWUEGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFN2O/c1-5-2-7(11)6(3-8(5)12)9-4-13-10(15)14-9/h2-3,9H,4H2,1H3,(H2,13,14,15).
What are the key properties of 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one?
4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one has a molecular weight of 228.65 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one is sourced from PubChem (CID 116855884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).