4-hydroxy-N-(4-methylsulfanylphenyl)butanamide

C11H15NO2S — CID 79204834

IUPAC4-hydroxy-N-(4-methylsulfanylphenyl)butanamide
SMILESCSc1ccc(NC(=O)CCCO)cc1
InChIInChI=1S/C11H15NO2S/c1-15-10-6-4-9(5-7-10)12-11(14)3-2-8-13/h4-7,13H,2-3,8H2,1H3,(H,12,14)
InChIKeyGPZBOFNYYLXCKC-UHFFFAOYSA-N
MW225.31 g/mol
LogP2.12
Rot. Bonds5

About 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide

4-hydroxy-N-(4-methylsulfanylphenyl)butanamide (PubChem CID 79204834) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide.

Molecular Properties

Compound Name4-hydroxy-N-(4-methylsulfanylphenyl)butanamide
PubChem CID79204834
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name4-hydroxy-N-(4-methylsulfanylphenyl)butanamide
SMILESCSc1ccc(NC(=O)CCCO)cc1
InChIInChI=1S/C11H15NO2S/c1-15-10-6-4-9(5-7-10)12-11(14)3-2-8-13/h4-7,13H,2-3,8H2,1H3,(H,12,14)
InChIKeyGPZBOFNYYLXCKC-UHFFFAOYSA-N
XLogP2.12
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(4-methylsulfanylphenyl)butanamide;hydrochloride
CID 119273782
5-bromo-N-(4-methylsulfanylphenyl)pentanamide
CID 107907215
N-(4-methylsulfanylphenyl)-4-(propan-2-ylamino)butanamide
CID 60851275
N'-(4-methylsulfanylphenyl)butanediamide
CID 142651980
4-azido-N-(4-methylsulfanylphenyl)butanamide
CID 42611968
3-(4-methylsulfanylanilino)-3-oxopropanoic acid
CID 62230727
N-(4-cyclopentylsulfanylphenyl)-4-hydroxybutanamide
CID 79200166
ethyl 4-(4-methylsulfanylanilino)-4-oxobutanoate
CID 9179743
4-(4-acetylphenoxy)-N-(4-methylsulfanylphenyl)butanamide
CID 27364869
4-hydroxy-N-(4-phenylphenyl)butanamide
CID 79192454
4-(4-hydroxybutanoylamino)benzamide
CID 79203349
3-(2-hydroxyphenyl)-N-(4-methylsulfanylphenyl)propanamide
CID 42370206

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide?
The IUPAC name of 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide (CID 79204834) is 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide.
What is the SMILES notation for 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide?
The canonical SMILES for 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide is CSc1ccc(NC(=O)CCCO)cc1.
What is the InChIKey of 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide?
The InChIKey is GPZBOFNYYLXCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-15-10-6-4-9(5-7-10)12-11(14)3-2-8-13/h4-7,13H,2-3,8H2,1H3,(H,12,14).
What are the key properties of 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide?
4-hydroxy-N-(4-methylsulfanylphenyl)butanamide has a molecular weight of 225.31 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(4-methylsulfanylphenyl)butanamide is sourced from PubChem (CID 79204834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).