(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione

C13H22N2O5 — CID 99799557

IUPAC(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione
SMILESCOC[C@@]1(C)NC(=O)N(CCO[C@H]2CCCCO2)C1=O
InChIInChI=1S/C13H22N2O5/c1-13(9-18-2)11(16)15(12(17)14-13)6-8-20-10-5-3-4-7-19-10/h10H,3-9H2,1-2H3,(H,14,17)/t10-,13+/m0/s1
InChIKeyRIEFIKKHKJCIHR-GXFFZTMASA-N
MW286.33 g/mol
LogP0.49
Rot. Bonds6

About (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione

(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione (PubChem CID 99799557) has the molecular formula C13H22N2O5 and a molecular weight of 286.33 g/mol. Its IUPAC name is (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione
PubChem CID99799557
Molecular FormulaC13H22N2O5
Molecular Weight286.33 g/mol
Exact Mass286.15
IUPAC Name(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione
SMILESCOC[C@@]1(C)NC(=O)N(CCO[C@H]2CCCCO2)C1=O
InChIInChI=1S/C13H22N2O5/c1-13(9-18-2)11(16)15(12(17)14-13)6-8-20-10-5-3-4-7-19-10/h10H,3-9H2,1-2H3,(H,14,17)/t10-,13+/m0/s1
InChIKeyRIEFIKKHKJCIHR-GXFFZTMASA-N
XLogP0.49
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

3,3-dimethyl-1-[3-[(2R)-oxan-2-yl]oxypropyl]pyrrolidine-2,5-dione
CID 100761405
1-[2-(oxan-2-yloxy)ethyl]-3H-indol-2-one
CID 77211492
5-iodo-1-[2-(oxan-2-yloxy)ethyl]imidazole
CID 86687194
3-methyl-1-[2-(oxan-2-yloxy)ethyl]pyrrolidin-3-ol
CID 103358054
2-[(2-methyloxiran-2-yl)methoxy]oxane
CID 71425923
2-[3-(2-methoxyethoxy)propoxy]oxane
CID 158704924
1-[4-(oxan-2-yloxy)butyl]pyrrolidin-2-one
CID 10977596
(5R)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-(methoxymethyl)-5-methylimidazolidine-2,4-dione
CID 95307087
5-bromo-1-[2-(oxan-2-yloxy)ethyl]pyridin-2-one
CID 172614475
2,9-bis[2-(oxan-2-yloxy)ethyl]-2,4,9,11-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene
CID 101178662
[(3R)-3-methyl-1-[2-[(2S)-oxan-2-yl]oxyethyl]pyrrolidin-3-yl]methanol
CID 124863525
3-[2-(oxan-2-yloxy)ethoxy]oxolan-2-one
CID 121451856

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione (CID 99799557) is (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione is COC[C@@]1(C)NC(=O)N(CCO[C@H]2CCCCO2)C1=O.
What is the InChIKey of (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione?
The InChIKey is RIEFIKKHKJCIHR-GXFFZTMASA-N. The full InChI is InChI=1S/C13H22N2O5/c1-13(9-18-2)11(16)15(12(17)14-13)6-8-20-10-5-3-4-7-19-10/h10H,3-9H2,1-2H3,(H,14,17)/t10-,13+/m0/s1.
What are the key properties of (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione?
(5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione has a molecular weight of 286.33 g/mol, XLogP of 0.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(methoxymethyl)-5-methyl-3-[2-[(2S)-oxan-2-yl]oxyethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 99799557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).