4-hydroxybutanamide

C4H9NO2 — CID 13562

IUPAC4-hydroxybutanamide
SMILESNC(=O)CCCO
InChIInChI=1S/C4H9NO2/c5-4(7)2-1-3-6/h6H,1-3H2,(H2,5,7)
InChIKeyLOESDOAIWSCMKM-UHFFFAOYSA-N
MW103.12 g/mol
LogP-0.76
Rot. Bonds3

About 4-hydroxybutanamide

4-hydroxybutanamide (PubChem CID 13562) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is 4-hydroxybutanamide.

Molecular Properties

Compound Name4-hydroxybutanamide
PubChem CID13562
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC Name4-hydroxybutanamide
SMILESNC(=O)CCCO
InChIInChI=1S/C4H9NO2/c5-4(7)2-1-3-6/h6H,1-3H2,(H2,5,7)
InChIKeyLOESDOAIWSCMKM-UHFFFAOYSA-N
XLogP-0.76
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-Dihydroxybutanamide
CID 18386929
4-Hydroxypentaneamide
CID 21402940
3-(Fluoromethyl)-4-hydroxybutanamide
CID 141155830
(3S)-3-(fluoromethyl)-4-hydroxybutanamide
CID 141199180
4-Amino-4-hydroxybutanamide
CID 444566
4-Hydroxy-3,3-dimethylbutanamide
CID 10176153
4-Hydroxy-3-methylbutanamide
CID 10197668
(2R)-2,4-dihydroxybutanamide
CID 12009649
4-Hydroxy-3-(hydroxymethyl)-3-methylbutanamide
CID 17934875
4-Hydroxy-3-(hydroxymethyl)-2-methylbutanamide
CID 19026845
4,4-Dihydroxybutanamide
CID 20522515
4-Hydroxybutanamide;hydrochloride
CID 21222088

Frequently Asked Questions

What is the IUPAC name of 4-hydroxybutanamide?
The IUPAC name of 4-hydroxybutanamide (CID 13562) is 4-hydroxybutanamide.
What is the SMILES notation for 4-hydroxybutanamide?
The canonical SMILES for 4-hydroxybutanamide is NC(=O)CCCO.
What is the InChIKey of 4-hydroxybutanamide?
The InChIKey is LOESDOAIWSCMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c5-4(7)2-1-3-6/h6H,1-3H2,(H2,5,7).
What are the key properties of 4-hydroxybutanamide?
4-hydroxybutanamide has a molecular weight of 103.12 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxybutanamide is sourced from PubChem (CID 13562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).