4-hydroxy-2,3-dimethylbutanamide

C6H13NO2 — CID 22242529

IUPAC4-hydroxy-2,3-dimethylbutanamide
SMILESCC(CO)C(C)C(N)=O
InChIInChI=1S/C6H13NO2/c1-4(3-8)5(2)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9)
InChIKeyBNZZCHWGHWFPRI-UHFFFAOYSA-N
MW131.17 g/mol
LogP-0.26
Rot. Bonds3

About 4-hydroxy-2,3-dimethylbutanamide

4-hydroxy-2,3-dimethylbutanamide (PubChem CID 22242529) has the molecular formula C6H13NO2 and a molecular weight of 131.17 g/mol. Its IUPAC name is 4-hydroxy-2,3-dimethylbutanamide.

Molecular Properties

Compound Name4-hydroxy-2,3-dimethylbutanamide
PubChem CID22242529
Molecular FormulaC6H13NO2
Molecular Weight131.17 g/mol
Exact Mass131.09
IUPAC Name4-hydroxy-2,3-dimethylbutanamide
SMILESCC(CO)C(C)C(N)=O
InChIInChI=1S/C6H13NO2/c1-4(3-8)5(2)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9)
InChIKeyBNZZCHWGHWFPRI-UHFFFAOYSA-N
XLogP-0.26
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.17
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2,3-dimethylbutanamide?
The IUPAC name of 4-hydroxy-2,3-dimethylbutanamide (CID 22242529) is 4-hydroxy-2,3-dimethylbutanamide.
What is the SMILES notation for 4-hydroxy-2,3-dimethylbutanamide?
The canonical SMILES for 4-hydroxy-2,3-dimethylbutanamide is CC(CO)C(C)C(N)=O.
What is the InChIKey of 4-hydroxy-2,3-dimethylbutanamide?
The InChIKey is BNZZCHWGHWFPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-4(3-8)5(2)6(7)9/h4-5,8H,3H2,1-2H3,(H2,7,9).
What are the key properties of 4-hydroxy-2,3-dimethylbutanamide?
4-hydroxy-2,3-dimethylbutanamide has a molecular weight of 131.17 g/mol, XLogP of -0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2,3-dimethylbutanamide is sourced from PubChem (CID 22242529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).