4-hydroxy-2-methylbutanamide

C5H11NO2 — CID 22175060

IUPAC4-hydroxy-2-methylbutanamide
SMILESCC(CCO)C(N)=O
InChIInChI=1S/C5H11NO2/c1-4(2-3-7)5(6)8/h4,7H,2-3H2,1H3,(H2,6,8)
InChIKeyOQGHTRNRMYIWBJ-UHFFFAOYSA-N
MW117.15 g/mol
LogP-0.51
Rot. Bonds3

About 4-hydroxy-2-methylbutanamide

4-hydroxy-2-methylbutanamide (PubChem CID 22175060) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is 4-hydroxy-2-methylbutanamide.

Molecular Properties

Compound Name4-hydroxy-2-methylbutanamide
PubChem CID22175060
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name4-hydroxy-2-methylbutanamide
SMILESCC(CCO)C(N)=O
InChIInChI=1S/C5H11NO2/c1-4(2-3-7)5(6)8/h4,7H,2-3H2,1H3,(H2,6,8)
InChIKeyOQGHTRNRMYIWBJ-UHFFFAOYSA-N
XLogP-0.51
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-Hydroxybutyramide
CID 13562
(2S)-2-(hydroxymethyl)-3-methylbutanamide
CID 59895885
2-Methyln-(2-hydroxyethyl) propionamide
CID 21402965
2-Fluoro-4-hydroxy-2-methylbutanamide
CID 87253844
(2R)-2-fluoro-4-hydroxy-2-methylbutanamide
CID 88548045
4,4,4-Trifluoro-3-(hydroxymethyl)butanamide
CID 89116568
3-(Fluoromethyl)-4-hydroxybutanamide
CID 141155830
(3S)-3-(fluoromethyl)-4-hydroxybutanamide
CID 141199180
(2S)-2-fluoro-4-hydroxy-2-methylbutanamide
CID 173464744
4-Hydroxy-3,3-dimethylbutanamide
CID 10176153
4-Hydroxy-3-methylbutanamide
CID 10197668
4-Methoxy-2-methylbutanamide
CID 17911000

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-methylbutanamide?
The IUPAC name of 4-hydroxy-2-methylbutanamide (CID 22175060) is 4-hydroxy-2-methylbutanamide.
What is the SMILES notation for 4-hydroxy-2-methylbutanamide?
The canonical SMILES for 4-hydroxy-2-methylbutanamide is CC(CCO)C(N)=O.
What is the InChIKey of 4-hydroxy-2-methylbutanamide?
The InChIKey is OQGHTRNRMYIWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c1-4(2-3-7)5(6)8/h4,7H,2-3H2,1H3,(H2,6,8).
What are the key properties of 4-hydroxy-2-methylbutanamide?
4-hydroxy-2-methylbutanamide has a molecular weight of 117.15 g/mol, XLogP of -0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-methylbutanamide is sourced from PubChem (CID 22175060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).