(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one

C10H11ClN2O — CID 131150939

IUPAC(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one
SMILESCc1cccc(Cl)c1[C@H]1CNC(=O)N1
InChIInChI=1S/C10H11ClN2O/c1-6-3-2-4-7(11)9(6)8-5-12-10(14)13-8/h2-4,8H,5H2,1H3,(H2,12,13,14)/t8-/m1/s1
InChIKeyJJVMRDFUKGISDS-MRVPVSSYSA-N
MW210.66 g/mol
LogP2.00
Rot. Bonds1

About (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one

(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one (PubChem CID 131150939) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one
PubChem CID131150939
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one
SMILESCc1cccc(Cl)c1[C@H]1CNC(=O)N1
InChIInChI=1S/C10H11ClN2O/c1-6-3-2-4-7(11)9(6)8-5-12-10(14)13-8/h2-4,8H,5H2,1H3,(H2,12,13,14)/t8-/m1/s1
InChIKeyJJVMRDFUKGISDS-MRVPVSSYSA-N
XLogP2.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-chloro-6-fluorophenyl)imidazolidin-2-one
CID 130148791
(4S)-4-(3-chloro-2-hydroxyphenyl)imidazolidin-2-one
CID 131078848
(4S)-4-(3,6-dichloro-2-fluorophenyl)imidazolidin-2-one
CID 171252831
(4R)-4-(2-chloro-6-methylphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184596
(4R)-4-(3-chloro-4-methylphenyl)imidazolidin-2-one
CID 130642849
(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one
CID 171252504
(4S)-4-(2,3,4,5,6-pentamethylphenyl)imidazolidin-2-one
CID 171252803
(4S)-4-(4-hydroxy-2,6-dimethylphenyl)imidazolidin-2-one
CID 131574869
3-(2-chloro-6-methylphenyl)pyrrolidine
CID 117103928
(3S)-3-(2-chloro-6-methylphenyl)morpholine
CID 131168891
4-(2-chloro-5-fluoro-4-methylphenyl)imidazolidin-2-one
CID 116855884
5-(2-chloro-6-methylphenyl)cyclohexane-1,3-dione
CID 143450624

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one?
The IUPAC name of (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one (CID 131150939) is (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one.
What is the SMILES notation for (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one?
The canonical SMILES for (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one is Cc1cccc(Cl)c1[C@H]1CNC(=O)N1.
What is the InChIKey of (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one?
The InChIKey is JJVMRDFUKGISDS-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-6-3-2-4-7(11)9(6)8-5-12-10(14)13-8/h2-4,8H,5H2,1H3,(H2,12,13,14)/t8-/m1/s1.
What are the key properties of (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one?
(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one has a molecular weight of 210.66 g/mol, XLogP of 2.00, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one is sourced from PubChem (CID 131150939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).