(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one

C9H9ClN2O2 — CID 92534449

IUPAC(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one
SMILESO=C1CN[C@H](c2ccc(Cl)cc2)N1O
InChIInChI=1S/C9H9ClN2O2/c10-7-3-1-6(2-4-7)9-11-5-8(13)12(9)14/h1-4,9,11,14H,5H2/t9-/m0/s1
InChIKeyFENHTBUIOQWPRM-VIFPVBQESA-N
MW212.64 g/mol
LogP1.16
Rot. Bonds1

About (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one

(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one (PubChem CID 92534449) has the molecular formula C9H9ClN2O2 and a molecular weight of 212.64 g/mol. Its IUPAC name is (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one.

Molecular Properties

Compound Name(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one
PubChem CID92534449
Molecular FormulaC9H9ClN2O2
Molecular Weight212.64 g/mol
Exact Mass212.04
IUPAC Name(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one
SMILESO=C1CN[C@H](c2ccc(Cl)cc2)N1O
InChIInChI=1S/C9H9ClN2O2/c10-7-3-1-6(2-4-7)9-11-5-8(13)12(9)14/h1-4,9,11,14H,5H2/t9-/m0/s1
InChIKeyFENHTBUIOQWPRM-VIFPVBQESA-N
XLogP1.16
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.64
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one?
The IUPAC name of (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one (CID 92534449) is (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one.
What is the SMILES notation for (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one?
The canonical SMILES for (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one is O=C1CN[C@H](c2ccc(Cl)cc2)N1O.
What is the InChIKey of (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one?
The InChIKey is FENHTBUIOQWPRM-VIFPVBQESA-N. The full InChI is InChI=1S/C9H9ClN2O2/c10-7-3-1-6(2-4-7)9-11-5-8(13)12(9)14/h1-4,9,11,14H,5H2/t9-/m0/s1.
What are the key properties of (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one?
(2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one has a molecular weight of 212.64 g/mol, XLogP of 1.16, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-chlorophenyl)-3-hydroxyimidazolidin-4-one is sourced from PubChem (CID 92534449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).