(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one

C11H14N2O3 — CID 171252504

IUPAC(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one
SMILESCOc1cccc(OC)c1[C@@H]1CNC(=O)N1
InChIInChI=1S/C11H14N2O3/c1-15-8-4-3-5-9(16-2)10(8)7-6-12-11(14)13-7/h3-5,7H,6H2,1-2H3,(H2,12,13,14)/t7-/m0/s1
InChIKeyVWZNJMVQDHVGPW-ZETCQYMHSA-N
MW222.24 g/mol
LogP1.06
Rot. Bonds3

About (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one

(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one (PubChem CID 171252504) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one
PubChem CID171252504
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name(4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one
SMILESCOc1cccc(OC)c1[C@@H]1CNC(=O)N1
InChIInChI=1S/C11H14N2O3/c1-15-8-4-3-5-9(16-2)10(8)7-6-12-11(14)13-7/h3-5,7H,6H2,1-2H3,(H2,12,13,14)/t7-/m0/s1
InChIKeyVWZNJMVQDHVGPW-ZETCQYMHSA-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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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one?
The IUPAC name of (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one (CID 171252504) is (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one.
What is the SMILES notation for (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one?
The canonical SMILES for (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one is COc1cccc(OC)c1[C@@H]1CNC(=O)N1.
What is the InChIKey of (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one?
The InChIKey is VWZNJMVQDHVGPW-ZETCQYMHSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-15-8-4-3-5-9(16-2)10(8)7-6-12-11(14)13-7/h3-5,7H,6H2,1-2H3,(H2,12,13,14)/t7-/m0/s1.
What are the key properties of (4R)-4-(2,6-dimethoxyphenyl)imidazolidin-2-one?
(4R)-4-(2,6-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-(2,6-dimethoxyphenyl)imidazolidin-2-one is sourced from PubChem (CID 171252504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).