2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide

C6H13NO3 — CID 5232000

IUPAC2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)CO
InChIInChI=1S/C6H13NO3/c1-2-5(3-8)7-6(10)4-9/h5,8-9H,2-4H2,1H3,(H,7,10)
InChIKeyWAUQXKINYVHBDD-UHFFFAOYSA-N
MW147.17 g/mol
LogP-1.13
Rot. Bonds4

About 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide

2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide (PubChem CID 5232000) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide.

Molecular Properties

Compound Name2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide
PubChem CID5232000
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)CO
InChIInChI=1S/C6H13NO3/c1-2-5(3-8)7-6(10)4-9/h5,8-9H,2-4H2,1H3,(H,7,10)
InChIKeyWAUQXKINYVHBDD-UHFFFAOYSA-N
XLogP-1.13
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide?
The IUPAC name of 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide (CID 5232000) is 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide.
What is the SMILES notation for 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide?
The canonical SMILES for 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide is CCC(CO)NC(=O)CO.
What is the InChIKey of 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide?
The InChIKey is WAUQXKINYVHBDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-2-5(3-8)7-6(10)4-9/h5,8-9H,2-4H2,1H3,(H,7,10).
What are the key properties of 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide?
2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide has a molecular weight of 147.17 g/mol, XLogP of -1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1-hydroxybutan-2-yl)acetamide is sourced from PubChem (CID 5232000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).