2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide

C7H11N3O3 — CID 106400404

IUPAC2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide
SMILESCC(C)(O)C(=O)NCc1ncon1
InChIInChI=1S/C7H11N3O3/c1-7(2,12)6(11)8-3-5-9-4-13-10-5/h4,12H,3H2,1-2H3,(H,8,11)
InChIKeyFCEWNMYDXPLIMU-UHFFFAOYSA-N
MW185.18 g/mol
LogP-0.54
Rot. Bonds3

About 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide

2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide (PubChem CID 106400404) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide
PubChem CID106400404
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Name2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide
SMILESCC(C)(O)C(=O)NCc1ncon1
InChIInChI=1S/C7H11N3O3/c1-7(2,12)6(11)8-3-5-9-4-13-10-5/h4,12H,3H2,1-2H3,(H,8,11)
InChIKeyFCEWNMYDXPLIMU-UHFFFAOYSA-N
XLogP-0.54
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide (CID 106400404) is 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide is CC(C)(O)C(=O)NCc1ncon1.
What is the InChIKey of 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide?
The InChIKey is FCEWNMYDXPLIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c1-7(2,12)6(11)8-3-5-9-4-13-10-5/h4,12H,3H2,1-2H3,(H,8,11).
What are the key properties of 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide?
2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide has a molecular weight of 185.18 g/mol, XLogP of -0.54, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide is sourced from PubChem (CID 106400404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).