(2S)-3-hydroxy-N,2-dimethylpropanamide

C5H11NO2 — CID 58246856

IUPAC(2S)-3-hydroxy-N,2-dimethylpropanamide
SMILESCNC(=O)[C@@H](C)CO
InChIInChI=1S/C5H11NO2/c1-4(3-7)5(8)6-2/h4,7H,3H2,1-2H3,(H,6,8)/t4-/m0/s1
InChIKeyGBCHGKJHHHFXHR-BYPYZUCNSA-N
MW117.15 g/mol
LogP-0.64
Rot. Bonds2

About (2S)-3-hydroxy-N,2-dimethylpropanamide

(2S)-3-hydroxy-N,2-dimethylpropanamide (PubChem CID 58246856) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (2S)-3-hydroxy-N,2-dimethylpropanamide.

Molecular Properties

Compound Name(2S)-3-hydroxy-N,2-dimethylpropanamide
PubChem CID58246856
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(2S)-3-hydroxy-N,2-dimethylpropanamide
SMILESCNC(=O)[C@@H](C)CO
InChIInChI=1S/C5H11NO2/c1-4(3-7)5(8)6-2/h4,7H,3H2,1-2H3,(H,6,8)/t4-/m0/s1
InChIKeyGBCHGKJHHHFXHR-BYPYZUCNSA-N
XLogP-0.64
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-3-hydroxy-N,2-dimethylpropanamide 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

5-hydroxy-N,2,4-trimethylpentanamide
CID 157214325
N,2-dimethyl-3-sulfanylpropanamide
CID 13075016
N,2,5-trimethylhexanamide
CID 78065622
(2R)-2,3-dihydroxy-N-methylpropanamide
CID 89249819
(2S)-N,2,4,4-tetramethylpentanamide
CID 58247049
1,3-dihydroxypropan-2-yl N-[2-methyl-3-(methylamino)-3-oxopropyl]carbamate;ethane
CID 145090115
4-methyl-5-(methylamino)-5-oxopentanoyl fluoride
CID 20695613
N,2-dimethyl-5-oxopentanamide
CID 20693317
(2S)-3-acetamido-2-methyl-N-[(2S)-2-methyl-3-[[(2S)-2-methyl-3-[[(2S)-2-methyl-3-[[(2S)-2-methyl-3-[[(2S)-2-methyl-3-(methylamino)-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]propanamide
CID 101104048
S-methyl N-[[(2R)-3-hydroxy-2-methylpropanoyl]amino]carbamothioate
CID 88910601
2-(hydroxymethyl)-N-methylbutanamide
CID 58973980
tert-butyl N-[(2S)-1-[[(2S)-3-hydroxy-1-(methylamino)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 102247378

Frequently Asked Questions

What is the IUPAC name of (2S)-3-hydroxy-N,2-dimethylpropanamide?
The IUPAC name of (2S)-3-hydroxy-N,2-dimethylpropanamide (CID 58246856) is (2S)-3-hydroxy-N,2-dimethylpropanamide.
What is the SMILES notation for (2S)-3-hydroxy-N,2-dimethylpropanamide?
The canonical SMILES for (2S)-3-hydroxy-N,2-dimethylpropanamide is CNC(=O)[C@@H](C)CO.
What is the InChIKey of (2S)-3-hydroxy-N,2-dimethylpropanamide?
The InChIKey is GBCHGKJHHHFXHR-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H11NO2/c1-4(3-7)5(8)6-2/h4,7H,3H2,1-2H3,(H,6,8)/t4-/m0/s1.
What are the key properties of (2S)-3-hydroxy-N,2-dimethylpropanamide?
(2S)-3-hydroxy-N,2-dimethylpropanamide has a molecular weight of 117.15 g/mol, XLogP of -0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-hydroxy-N,2-dimethylpropanamide is sourced from PubChem (CID 58246856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).