3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide

C6H13NO4 — CID 87120513

IUPAC3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide
SMILESO=C(NCCO)C(CO)CO
InChIInChI=1S/C6H13NO4/c8-2-1-7-6(11)5(3-9)4-10/h5,8-10H,1-4H2,(H,7,11)
InChIKeyYEBPBRYPBSDCCU-UHFFFAOYSA-N
MW163.17 g/mol
LogP-2.30
Rot. Bonds5

About 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide

3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide (PubChem CID 87120513) has the molecular formula C6H13NO4 and a molecular weight of 163.17 g/mol. Its IUPAC name is 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide
PubChem CID87120513
Molecular FormulaC6H13NO4
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide
SMILESO=C(NCCO)C(CO)CO
InChIInChI=1S/C6H13NO4/c8-2-1-7-6(11)5(3-9)4-10/h5,8-10H,1-4H2,(H,7,11)
InChIKeyYEBPBRYPBSDCCU-UHFFFAOYSA-N
XLogP-2.30
TPSA89.79 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 5-2.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide with MolForge

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

Launch Full Analysis

Related Compounds

Propanamide, N-(2-hydroxyethyl)-3-methoxy-
CID 15430830
3-hydroxy-N-(2-hydroxyethyl)propanamide
CID 11018907
N-Ethyl-3-hydroxypropanamide
CID 15561473
n-(2-Hydroxyethyl)-2-methylpropanamide
CID 221962
(2R)-3-hydroxy-2-methyl-N-(2-methylpropyl)propanamide
CID 131228948
3-hydroxy-N-(2-hydroxyethyl)-2-methylbutanamide
CID 20648231
3-hydroxy-N-(2-methylpropyl)propanamide
CID 20735578
3,3-dihydroxy-N-(2-hydroxyethyl)-2-methylpropanamide
CID 21330069
2-[(3-Hydroxy-2-methylpropanoyl)amino]acetic acid
CID 22123992
3-hydroxy-N-(2-hydroxyethyl)-2,2-dimethylpropanamide
CID 22892515
N-(3-Hydroxypropyl)isobutyramide
CID 23112267
N-ethyl-3-hydroxy-2-methylpropanamide
CID 53740794

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide?
The IUPAC name of 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide (CID 87120513) is 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide.
What is the SMILES notation for 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide?
The canonical SMILES for 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide is O=C(NCCO)C(CO)CO.
What is the InChIKey of 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide?
The InChIKey is YEBPBRYPBSDCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO4/c8-2-1-7-6(11)5(3-9)4-10/h5,8-10H,1-4H2,(H,7,11).
What are the key properties of 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide?
3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide has a molecular weight of 163.17 g/mol, XLogP of -2.30, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-hydroxyethyl)-2-(hydroxymethyl)propanamide is sourced from PubChem (CID 87120513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).