5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one

C8H11N3O3 — CID 70556132

IUPAC5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one
SMILESCc1cc(N2C(=O)NCC2CO)on1
InChIInChI=1S/C8H11N3O3/c1-5-2-7(14-10-5)11-6(4-12)3-9-8(11)13/h2,6,12H,3-4H2,1H3,(H,9,13)
InChIKeyXPKKSDKYTZZBBV-UHFFFAOYSA-N
MW197.19 g/mol
LogP-0.13
Rot. Bonds2

About 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one

5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one (PubChem CID 70556132) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one.

Molecular Properties

Compound Name5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one
PubChem CID70556132
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one
SMILESCc1cc(N2C(=O)NCC2CO)on1
InChIInChI=1S/C8H11N3O3/c1-5-2-7(14-10-5)11-6(4-12)3-9-8(11)13/h2,6,12H,3-4H2,1H3,(H,9,13)
InChIKeyXPKKSDKYTZZBBV-UHFFFAOYSA-N
XLogP-0.13
TPSA78.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The IUPAC name of 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one (CID 70556132) is 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one.
What is the SMILES notation for 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The canonical SMILES for 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one is Cc1cc(N2C(=O)NCC2CO)on1.
What is the InChIKey of 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one?
The InChIKey is XPKKSDKYTZZBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-5-2-7(14-10-5)11-6(4-12)3-9-8(11)13/h2,6,12H,3-4H2,1H3,(H,9,13).
What are the key properties of 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one?
5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one has a molecular weight of 197.19 g/mol, XLogP of -0.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-1-(3-methyl-1,2-oxazol-5-yl)imidazolidin-2-one is sourced from PubChem (CID 70556132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).