1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one

C17H15F3N2O2 — CID 134259735

IUPAC1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one
SMILESCc1ccccc1N1CCN(c2ccc(OC(F)(F)F)cc2)C1=O
InChIInChI=1S/C17H15F3N2O2/c1-12-4-2-3-5-15(12)22-11-10-21(16(22)23)13-6-8-14(9-7-13)24-17(18,19)20/h2-9H,10-11H2,1H3
InChIKeyRZUKVPTWVMDGGU-UHFFFAOYSA-N
MW336.31 g/mol
LogP4.34
Rot. Bonds3

About 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one

1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one (PubChem CID 134259735) has the molecular formula C17H15F3N2O2 and a molecular weight of 336.31 g/mol. Its IUPAC name is 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one
PubChem CID134259735
Molecular FormulaC17H15F3N2O2
Molecular Weight336.31 g/mol
Exact Mass336.11
IUPAC Name1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one
SMILESCc1ccccc1N1CCN(c2ccc(OC(F)(F)F)cc2)C1=O
InChIInChI=1S/C17H15F3N2O2/c1-12-4-2-3-5-15(12)22-11-10-21(16(22)23)13-6-8-14(9-7-13)24-17(18,19)20/h2-9H,10-11H2,1H3
InChIKeyRZUKVPTWVMDGGU-UHFFFAOYSA-N
XLogP4.34
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.31
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The IUPAC name of 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one (CID 134259735) is 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one is Cc1ccccc1N1CCN(c2ccc(OC(F)(F)F)cc2)C1=O.
What is the InChIKey of 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The InChIKey is RZUKVPTWVMDGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N2O2/c1-12-4-2-3-5-15(12)22-11-10-21(16(22)23)13-6-8-14(9-7-13)24-17(18,19)20/h2-9H,10-11H2,1H3.
What are the key properties of 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one?
1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one has a molecular weight of 336.31 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-3-[4-(trifluoromethoxy)phenyl]imidazolidin-2-one is sourced from PubChem (CID 134259735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).