(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one

C11H14N2O3 — CID 171252494

IUPAC(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one
SMILESCOc1cccc([C@@H]2CNC(=O)N2)c1OC
InChIInChI=1S/C11H14N2O3/c1-15-9-5-3-4-7(10(9)16-2)8-6-12-11(14)13-8/h3-5,8H,6H2,1-2H3,(H2,12,13,14)/t8-/m0/s1
InChIKeyXAQPKVSXSGBSAD-QMMMGPOBSA-N
MW222.24 g/mol
LogP1.06
Rot. Bonds3

About (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one

(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one (PubChem CID 171252494) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one
PubChem CID171252494
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one
SMILESCOc1cccc([C@@H]2CNC(=O)N2)c1OC
InChIInChI=1S/C11H14N2O3/c1-15-9-5-3-4-7(10(9)16-2)8-6-12-11(14)13-8/h3-5,8H,6H2,1-2H3,(H2,12,13,14)/t8-/m0/s1
InChIKeyXAQPKVSXSGBSAD-QMMMGPOBSA-N
XLogP1.06
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-4-(2-hydroxy-3-methoxyphenyl)imidazolidin-2-one
CID 131302642
(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one
CID 171252504
(4R)-4-(2,3-dimethoxyphenyl)-1,3-oxazinan-2-one
CID 171184846
(2R)-2-(2,3-dimethoxyphenyl)azetidine;hydrochloride
CID 171197120
4-(2,3-dimethoxyphenyl)pyrrolidin-2-one
CID 66106301
5-(2,3-dimethoxyphenyl)pyrazolidin-3-one
CID 4054499
1-cyclopropyl-2,3-dimethoxybenzene
CID 22923325
(4S)-4-(4-methoxy-2-methylphenyl)imidazolidin-2-one
CID 171252808
6-(2,3-dimethoxyphenyl)-3-azabicyclo[3.1.0]hexane
CID 83822143
(4S)-4-(3-bromo-2-fluorophenyl)imidazolidin-2-one
CID 130707431
3-(2,3-dimethoxyphenyl)-2-methylidenecyclopentan-1-one
CID 139508683
1,2,3-trimethoxybenzene;hydrofluoride
CID 174818666

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one?
The IUPAC name of (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one (CID 171252494) is (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one.
What is the SMILES notation for (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one?
The canonical SMILES for (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one is COc1cccc([C@@H]2CNC(=O)N2)c1OC.
What is the InChIKey of (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one?
The InChIKey is XAQPKVSXSGBSAD-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-15-9-5-3-4-7(10(9)16-2)8-6-12-11(14)13-8/h3-5,8H,6H2,1-2H3,(H2,12,13,14)/t8-/m0/s1.
What are the key properties of (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one?
(4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one has a molecular weight of 222.24 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2,3-dimethoxyphenyl)imidazolidin-2-one is sourced from PubChem (CID 171252494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).