(2S)-2-hydroxy-4-iodobutanamide

C4H8INO2 — CID 143841991

IUPAC(2S)-2-hydroxy-4-iodobutanamide
SMILESNC(=O)[C@@H](O)CCI
InChIInChI=1S/C4H8INO2/c5-2-1-3(7)4(6)8/h3,7H,1-2H2,(H2,6,8)/t3-/m0/s1
InChIKeyCZUDMVSFYLPQBX-VKHMYHEASA-N
MW229.02 g/mol
LogP-0.34
Rot. Bonds3

About (2S)-2-hydroxy-4-iodobutanamide

(2S)-2-hydroxy-4-iodobutanamide (PubChem CID 143841991) has the molecular formula C4H8INO2 and a molecular weight of 229.02 g/mol. Its IUPAC name is (2S)-2-hydroxy-4-iodobutanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-4-iodobutanamide
PubChem CID143841991
Molecular FormulaC4H8INO2
Molecular Weight229.02 g/mol
Exact Mass228.96
IUPAC Name(2S)-2-hydroxy-4-iodobutanamide
SMILESNC(=O)[C@@H](O)CCI
InChIInChI=1S/C4H8INO2/c5-2-1-3(7)4(6)8/h3,7H,1-2H2,(H2,6,8)/t3-/m0/s1
InChIKeyCZUDMVSFYLPQBX-VKHMYHEASA-N
XLogP-0.34
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.02
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-hydroxypentanediamide
CID 559184
2,5,5,6,6-pentahydroxyhexanamide
CID 145336879
2-hydroxyoctadecanamide
CID 14598043
2-hydroxy-6-oxohexanamide
CID 175466908
2-hydroxy-4-(4-iodophenyl)butanamide
CID 154976499
2-hydroxybutanamide;hydrochloride
CID 87384831
5-ethylsulfanyl-2-hydroxypentanamide
CID 141016967
2-hydroxy-4-oxopentanamide
CID 54002232
potassium 4-amino-3-hydroxy-4-oxobutanoate
CID 75480412
3-(dimethylamino)-2-hydroxypropanamide;hydrochloride
CID 89312207
2-hydroxy-8-phenyloctanamide
CID 66822616
(2R)-4-iodobutan-2-ol
CID 13089080

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-4-iodobutanamide?
The IUPAC name of (2S)-2-hydroxy-4-iodobutanamide (CID 143841991) is (2S)-2-hydroxy-4-iodobutanamide.
What is the SMILES notation for (2S)-2-hydroxy-4-iodobutanamide?
The canonical SMILES for (2S)-2-hydroxy-4-iodobutanamide is NC(=O)[C@@H](O)CCI.
What is the InChIKey of (2S)-2-hydroxy-4-iodobutanamide?
The InChIKey is CZUDMVSFYLPQBX-VKHMYHEASA-N. The full InChI is InChI=1S/C4H8INO2/c5-2-1-3(7)4(6)8/h3,7H,1-2H2,(H2,6,8)/t3-/m0/s1.
What are the key properties of (2S)-2-hydroxy-4-iodobutanamide?
(2S)-2-hydroxy-4-iodobutanamide has a molecular weight of 229.02 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-4-iodobutanamide is sourced from PubChem (CID 143841991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).