1-(5-chloro-2-fluorophenyl)imidazolidin-2-one

C9H8ClFN2O — CID 115370461

IUPAC1-(5-chloro-2-fluorophenyl)imidazolidin-2-one
SMILESO=C1NCCN1c1cc(Cl)ccc1F
InChIInChI=1S/C9H8ClFN2O/c10-6-1-2-7(11)8(5-6)13-4-3-12-9(13)14/h1-2,5H,3-4H2,(H,12,14)
InChIKeyCJHXRWYIARUSTI-UHFFFAOYSA-N
MW214.63 g/mol
LogP2.01
Rot. Bonds1

About 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one

1-(5-chloro-2-fluorophenyl)imidazolidin-2-one (PubChem CID 115370461) has the molecular formula C9H8ClFN2O and a molecular weight of 214.63 g/mol. Its IUPAC name is 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(5-chloro-2-fluorophenyl)imidazolidin-2-one
PubChem CID115370461
Molecular FormulaC9H8ClFN2O
Molecular Weight214.63 g/mol
Exact Mass214.03
IUPAC Name1-(5-chloro-2-fluorophenyl)imidazolidin-2-one
SMILESO=C1NCCN1c1cc(Cl)ccc1F
InChIInChI=1S/C9H8ClFN2O/c10-6-1-2-7(11)8(5-6)13-4-3-12-9(13)14/h1-2,5H,3-4H2,(H,12,14)
InChIKeyCJHXRWYIARUSTI-UHFFFAOYSA-N
XLogP2.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.63
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one?
The IUPAC name of 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one (CID 115370461) is 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one?
The canonical SMILES for 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one is O=C1NCCN1c1cc(Cl)ccc1F.
What is the InChIKey of 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one?
The InChIKey is CJHXRWYIARUSTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClFN2O/c10-6-1-2-7(11)8(5-6)13-4-3-12-9(13)14/h1-2,5H,3-4H2,(H,12,14).
What are the key properties of 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one?
1-(5-chloro-2-fluorophenyl)imidazolidin-2-one has a molecular weight of 214.63 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-fluorophenyl)imidazolidin-2-one is sourced from PubChem (CID 115370461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).