4-amino-2-hydroxybutanoate;hydrochloride

C4H9ClNO3- — CID 22475604

IUPAC4-amino-2-hydroxybutanoate;hydrochloride
SMILESCl.NCCC(O)C(=O)[O-]
InChIInChI=1S/C4H9NO3.ClH/c5-2-1-3(6)4(7)8;/h3,6H,1-2,5H2,(H,7,8);1H/p-1
InChIKeyHZYDSOQKJCJGSY-UHFFFAOYSA-M
MW154.57 g/mol
LogP-2.13
Rot. Bonds3

About 4-amino-2-hydroxybutanoate;hydrochloride

4-amino-2-hydroxybutanoate;hydrochloride (PubChem CID 22475604) has the molecular formula C4H9ClNO3- and a molecular weight of 154.57 g/mol. Its IUPAC name is 4-amino-2-hydroxybutanoate;hydrochloride.

Molecular Properties

Compound Name4-amino-2-hydroxybutanoate;hydrochloride
PubChem CID22475604
Molecular FormulaC4H9ClNO3-
Molecular Weight154.57 g/mol
Exact Mass154.03
IUPAC Name4-amino-2-hydroxybutanoate;hydrochloride
SMILESCl.NCCC(O)C(=O)[O-]
InChIInChI=1S/C4H9NO3.ClH/c5-2-1-3(6)4(7)8;/h3,6H,1-2,5H2,(H,7,8);1H/p-1
InChIKeyHZYDSOQKJCJGSY-UHFFFAOYSA-M
XLogP-2.13
TPSA86.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.57
LogP ≤ 5-2.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-4-azaniumyl-2-hydroxybutanoate
CID 38988563
(2R)-2-hydroxypentanedioate
CID 5460200
disodium;(2S)-2-hydroxypentanedioate
CID 56845267
(2S)-4-amino-2-hydroxy-N,N-dimethylbutanamide
CID 87476132
magnesium bis(2-hydroxyhexanoate)
CID 139844837
(2R)-2-hydroxyheptanoate
CID 7054559
butan-2-yl 4-amino-2-hydroxybutanoate
CID 107837492
(2S)-2-hydroxyoctadecanoate
CID 21145041
2-hydroxydocosanoate
CID 22361325
(2S)-2-amino-4-hydroxypentanedioate
CID 5460078
lithium 3-fluoro-2-hydroxypropanoate
CID 167714302
cadmium(2+);bis(2,3-dihydroxypropanoate)
CID 175584526

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-hydroxybutanoate;hydrochloride?
The IUPAC name of 4-amino-2-hydroxybutanoate;hydrochloride (CID 22475604) is 4-amino-2-hydroxybutanoate;hydrochloride.
What is the SMILES notation for 4-amino-2-hydroxybutanoate;hydrochloride?
The canonical SMILES for 4-amino-2-hydroxybutanoate;hydrochloride is Cl.NCCC(O)C(=O)[O-].
What is the InChIKey of 4-amino-2-hydroxybutanoate;hydrochloride?
The InChIKey is HZYDSOQKJCJGSY-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9NO3.ClH/c5-2-1-3(6)4(7)8;/h3,6H,1-2,5H2,(H,7,8);1H/p-1.
What are the key properties of 4-amino-2-hydroxybutanoate;hydrochloride?
4-amino-2-hydroxybutanoate;hydrochloride has a molecular weight of 154.57 g/mol, XLogP of -2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-hydroxybutanoate;hydrochloride is sourced from PubChem (CID 22475604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).