(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one

C5H10N2O2 — CID 13109360

IUPAC(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one
SMILESC[C@@H]1NC(=O)N(C)[C@@H]1O
InChIInChI=1S/C5H10N2O2/c1-3-4(8)7(2)5(9)6-3/h3-4,8H,1-2H3,(H,6,9)/t3-,4+/m0/s1
InChIKeyGBVDOGUKCKBXOB-IUYQGCFVSA-N
MW130.15 g/mol
LogP-0.65
Rot. Bonds

About (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one

(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one (PubChem CID 13109360) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one.

Molecular Properties

Compound Name(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one
PubChem CID13109360
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one
SMILESC[C@@H]1NC(=O)N(C)[C@@H]1O
InChIInChI=1S/C5H10N2O2/c1-3-4(8)7(2)5(9)6-3/h3-4,8H,1-2H3,(H,6,9)/t3-,4+/m0/s1
InChIKeyGBVDOGUKCKBXOB-IUYQGCFVSA-N
XLogP-0.65
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one?
The IUPAC name of (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one (CID 13109360) is (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one.
What is the SMILES notation for (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one?
The canonical SMILES for (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one is C[C@@H]1NC(=O)N(C)[C@@H]1O.
What is the InChIKey of (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one?
The InChIKey is GBVDOGUKCKBXOB-IUYQGCFVSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-3-4(8)7(2)5(9)6-3/h3-4,8H,1-2H3,(H,6,9)/t3-,4+/m0/s1.
What are the key properties of (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one?
(4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one has a molecular weight of 130.15 g/mol, XLogP of -0.65, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-5-hydroxy-1,4-dimethylimidazolidin-2-one is sourced from PubChem (CID 13109360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).