2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide

C7H15NO3 — CID 130024184

IUPAC2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide
SMILESCC(C)C(O)C(=O)NCCO
InChIInChI=1S/C7H15NO3/c1-5(2)6(10)7(11)8-3-4-9/h5-6,9-10H,3-4H2,1-2H3,(H,8,11)
InChIKeyZQXAEWHYFJXREW-UHFFFAOYSA-N
MW161.20 g/mol
LogP-0.89
Rot. Bonds4

About 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide

2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide (PubChem CID 130024184) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide
PubChem CID130024184
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide
SMILESCC(C)C(O)C(=O)NCCO
InChIInChI=1S/C7H15NO3/c1-5(2)6(10)7(11)8-3-4-9/h5-6,9-10H,3-4H2,1-2H3,(H,8,11)
InChIKeyZQXAEWHYFJXREW-UHFFFAOYSA-N
XLogP-0.89
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-0.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide 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

2,2-dichloro-N-(2-hydroxyethyl)acetamide
CID 5228722
(2S)-N-(2-hydroxyethyl)-2,3,3-trimethylbutanamide
CID 143641934
2-hydroxy-N-(2-hydroxyethyl)propanamide;phosphoric acid
CID 87238089
2-hydroxy-N-(2-hydroxyethyl)butanamide
CID 86250603
N-(2-hydroxyethyl)-2-methyl-3-oxobutanamide
CID 20648240
(2S)-2-hydroxy-N-[(2R)-2-hydroxybutyl]-3-methylbutanamide
CID 134189475
2-amino-N,N'-bis(2-hydroxyethyl)propanediamide
CID 173250932
3-amino-N-(2-hydroxyethyl)-2-methylpropanamide
CID 54555473
[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxobutan-2-yl]carbamic acid
CID 141293209
N-(2-hydroxyethyl)-2-methylsulfonylpropanamide
CID 115582870
2,3-dihydroxy-N,N'-dipropylbutanediamide
CID 13226339
2,4-diethyl-N,N'-bis(2-hydroxyethyl)pentanediamide
CID 89382357

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide?
The IUPAC name of 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide (CID 130024184) is 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide.
What is the SMILES notation for 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide?
The canonical SMILES for 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide is CC(C)C(O)C(=O)NCCO.
What is the InChIKey of 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide?
The InChIKey is ZQXAEWHYFJXREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-5(2)6(10)7(11)8-3-4-9/h5-6,9-10H,3-4H2,1-2H3,(H,8,11).
What are the key properties of 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide?
2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide has a molecular weight of 161.20 g/mol, XLogP of -0.89, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2-hydroxyethyl)-3-methylbutanamide is sourced from PubChem (CID 130024184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).