4-hydroxy-4-methylimidazolidin-2-one

C4H8N2O2 — CID 20517143

IUPAC4-hydroxy-4-methylimidazolidin-2-one
SMILESCC1(O)CNC(=O)N1
InChIInChI=1S/C4H8N2O2/c1-4(8)2-5-3(7)6-4/h8H,2H2,1H3,(H2,5,6,7)
InChIKeyBZBMRALHBKDATI-UHFFFAOYSA-N
MW116.12 g/mol
LogP-0.99
Rot. Bonds

About 4-hydroxy-4-methylimidazolidin-2-one

4-hydroxy-4-methylimidazolidin-2-one (PubChem CID 20517143) has the molecular formula C4H8N2O2 and a molecular weight of 116.12 g/mol. Its IUPAC name is 4-hydroxy-4-methylimidazolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-4-methylimidazolidin-2-one
PubChem CID20517143
Molecular FormulaC4H8N2O2
Molecular Weight116.12 g/mol
Exact Mass116.06
IUPAC Name4-hydroxy-4-methylimidazolidin-2-one
SMILESCC1(O)CNC(=O)N1
InChIInChI=1S/C4H8N2O2/c1-4(8)2-5-3(7)6-4/h8H,2H2,1H3,(H2,5,6,7)
InChIKeyBZBMRALHBKDATI-UHFFFAOYSA-N
XLogP-0.99
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.12
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-4-methylimidazolidin-2-one?
The IUPAC name of 4-hydroxy-4-methylimidazolidin-2-one (CID 20517143) is 4-hydroxy-4-methylimidazolidin-2-one.
What is the SMILES notation for 4-hydroxy-4-methylimidazolidin-2-one?
The canonical SMILES for 4-hydroxy-4-methylimidazolidin-2-one is CC1(O)CNC(=O)N1.
What is the InChIKey of 4-hydroxy-4-methylimidazolidin-2-one?
The InChIKey is BZBMRALHBKDATI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O2/c1-4(8)2-5-3(7)6-4/h8H,2H2,1H3,(H2,5,6,7).
What are the key properties of 4-hydroxy-4-methylimidazolidin-2-one?
4-hydroxy-4-methylimidazolidin-2-one has a molecular weight of 116.12 g/mol, XLogP of -0.99, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-4-methylimidazolidin-2-one is sourced from PubChem (CID 20517143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).