2-hydroxybutanamide;hydrochloride

C4H10ClNO2 — CID 87384831

IUPAC2-hydroxybutanamide;hydrochloride
SMILESCCC(O)C(N)=O.Cl
InChIInChI=1S/C4H9NO2.ClH/c1-2-3(6)4(5)7;/h3,6H,2H2,1H3,(H2,5,7);1H
InChIKeyLNBGSVMBPDUCAE-UHFFFAOYSA-N
MW139.58 g/mol
LogP-0.34
Rot. Bonds2

About 2-hydroxybutanamide;hydrochloride

2-hydroxybutanamide;hydrochloride (PubChem CID 87384831) has the molecular formula C4H10ClNO2 and a molecular weight of 139.58 g/mol. Its IUPAC name is 2-hydroxybutanamide;hydrochloride.

Molecular Properties

Compound Name2-hydroxybutanamide;hydrochloride
PubChem CID87384831
Molecular FormulaC4H10ClNO2
Molecular Weight139.58 g/mol
Exact Mass139.04
IUPAC Name2-hydroxybutanamide;hydrochloride
SMILESCCC(O)C(N)=O.Cl
InChIInChI=1S/C4H9NO2.ClH/c1-2-3(6)4(5)7;/h3,6H,2H2,1H3,(H2,5,7);1H
InChIKeyLNBGSVMBPDUCAE-UHFFFAOYSA-N
XLogP-0.34
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.58
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-2-hydroxyhexanamide
CID 87857755
2-aminobutanamide;hydrochloride
CID 14333659
3-(dimethylamino)-2-hydroxypropanamide;hydrochloride
CID 89312207
ethyl 2-hydroxybutanoate
CID 521365
(3S)-1-amino-3-hydroxypentan-2-one
CID 126711962
2-hydroxy-4-oxopentanamide
CID 54002232
2-hydroxyoctadecanamide
CID 14598043
3-hydroxypentanamide;hydrochloride
CID 174591125
sodium;(2S)-2-aminobutanamide;hydride;hydrochloride
CID 174916391
butane;2-hydroxypropanamide
CID 87347972
3-hydroxypentan-2-one;zinc
CID 174642767
(2R)-2-hydroxybutanethioic S-acid
CID 87799319

Frequently Asked Questions

What is the IUPAC name of 2-hydroxybutanamide;hydrochloride?
The IUPAC name of 2-hydroxybutanamide;hydrochloride (CID 87384831) is 2-hydroxybutanamide;hydrochloride.
What is the SMILES notation for 2-hydroxybutanamide;hydrochloride?
The canonical SMILES for 2-hydroxybutanamide;hydrochloride is CCC(O)C(N)=O.Cl.
What is the InChIKey of 2-hydroxybutanamide;hydrochloride?
The InChIKey is LNBGSVMBPDUCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2.ClH/c1-2-3(6)4(5)7;/h3,6H,2H2,1H3,(H2,5,7);1H.
What are the key properties of 2-hydroxybutanamide;hydrochloride?
2-hydroxybutanamide;hydrochloride has a molecular weight of 139.58 g/mol, XLogP of -0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxybutanamide;hydrochloride is sourced from PubChem (CID 87384831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).