(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one

C11H10F4N2O2 — CID 171252567

IUPAC(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one
SMILESO=C1NC[C@@H](c2ccc(OC(F)(F)C(F)F)cc2)N1
InChIInChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)19-7-3-1-6(2-4-7)8-5-16-10(18)17-8/h1-4,8-9H,5H2,(H2,16,17,18)/t8-/m0/s1
InChIKeyBSWCCKXZVUBKNI-QMMMGPOBSA-N
MW278.21 g/mol
LogP2.28
Rot. Bonds4

About (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one

(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one (PubChem CID 171252567) has the molecular formula C11H10F4N2O2 and a molecular weight of 278.21 g/mol. Its IUPAC name is (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one
PubChem CID171252567
Molecular FormulaC11H10F4N2O2
Molecular Weight278.21 g/mol
Exact Mass278.07
IUPAC Name(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one
SMILESO=C1NC[C@@H](c2ccc(OC(F)(F)C(F)F)cc2)N1
InChIInChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)19-7-3-1-6(2-4-7)8-5-16-10(18)17-8/h1-4,8-9H,5H2,(H2,16,17,18)/t8-/m0/s1
InChIKeyBSWCCKXZVUBKNI-QMMMGPOBSA-N
XLogP2.28
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.21
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4S)-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]imidazolidin-2-one
CID 171252821
(2S)-2-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]piperidine
CID 171195042
(4R)-4-(4-hydroxyphenyl)imidazolidin-2-one
CID 130739851
4-(4-propoxyphenyl)imidazolidin-2-one
CID 154396334
4-[(4S)-2-oxoimidazolidin-4-yl]benzoic acid
CID 131480890
5-bromo-2-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]-1,2,3,4-tetrahydroquinoline
CID 59009817
(4S)-4-[4-fluoro-3-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 171252694
(4R)-4-[2-hydroxy-5-(trifluoromethoxy)phenyl]imidazolidin-2-one
CID 171252592
(4S)-4-[4-chloro-3-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 171252733
1-iodo-4-(1,1,2,2-tetrafluoroethoxy)benzene
CID 26985388
(4R)-4-(4-pyrrolidin-1-ylphenyl)imidazolidin-2-one
CID 171252661
(4R)-4-(3-bromo-4-fluorophenyl)imidazolidin-2-one
CID 130723631

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one?
The IUPAC name of (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one (CID 171252567) is (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one.
What is the SMILES notation for (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one?
The canonical SMILES for (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one is O=C1NC[C@@H](c2ccc(OC(F)(F)C(F)F)cc2)N1.
What is the InChIKey of (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one?
The InChIKey is BSWCCKXZVUBKNI-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H10F4N2O2/c12-9(13)11(14,15)19-7-3-1-6(2-4-7)8-5-16-10(18)17-8/h1-4,8-9H,5H2,(H2,16,17,18)/t8-/m0/s1.
What are the key properties of (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one?
(4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one has a molecular weight of 278.21 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazolidin-2-one is sourced from PubChem (CID 171252567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).