4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide

C11H16N2O4S — CID 79192761

IUPAC4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide
SMILESNS(=O)(=O)c1cccc(CNC(=O)CCCO)c1
InChIInChI=1S/C11H16N2O4S/c12-18(16,17)10-4-1-3-9(7-10)8-13-11(15)5-2-6-14/h1,3-4,7,14H,2,5-6,8H2,(H,13,15)(H2,12,16,17)
InChIKeyPEQQSVSDFNZCDE-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.28
Rot. Bonds6

About 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide

4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide (PubChem CID 79192761) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide.

Molecular Properties

Compound Name4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide
PubChem CID79192761
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide
SMILESNS(=O)(=O)c1cccc(CNC(=O)CCCO)c1
InChIInChI=1S/C11H16N2O4S/c12-18(16,17)10-4-1-3-9(7-10)8-13-11(15)5-2-6-14/h1,3-4,7,14H,2,5-6,8H2,(H,13,15)(H2,12,16,17)
InChIKeyPEQQSVSDFNZCDE-UHFFFAOYSA-N
XLogP-0.28
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-bromophenyl)-N-[(3-sulfamoylphenyl)methyl]pentanamide
CID 55852739
N-[4-oxo-4-[(3-sulfamoylphenyl)methylamino]butyl]furan-2-carboxamide
CID 32563567
2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate
CID 79349048
2-methoxy-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 32567500
4-hydroxy-N-(3-sulfamoylphenyl)butanamide
CID 79200940
2-[2-oxo-2-[(3-sulfamoylphenyl)methylamino]ethyl]sulfanylacetic acid
CID 104569122
3-amino-N-[(3-sulfamoylphenyl)methyl]butanamide;hydrochloride
CID 119731394
2-(4-bromo-2-hydroxyphenyl)-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 166221897
2-(cyclopropylmethylamino)-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 60859149
2-amino-2-methyl-N-[(3-sulfamoylphenyl)methyl]propanamide
CID 61265020
3-chloro-2,2-dimethyl-N-[(3-sulfamoylphenyl)methyl]propanamide
CID 63680751
4-(4-ethoxyphenyl)-4-oxo-N-[(3-sulfamoylphenyl)methyl]butanamide
CID 55641527

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide?
The IUPAC name of 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide (CID 79192761) is 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide.
What is the SMILES notation for 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide?
The canonical SMILES for 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide is NS(=O)(=O)c1cccc(CNC(=O)CCCO)c1.
What is the InChIKey of 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide?
The InChIKey is PEQQSVSDFNZCDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c12-18(16,17)10-4-1-3-9(7-10)8-13-11(15)5-2-6-14/h1,3-4,7,14H,2,5-6,8H2,(H,13,15)(H2,12,16,17).
What are the key properties of 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide?
4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide has a molecular weight of 272.33 g/mol, XLogP of -0.28, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide is sourced from PubChem (CID 79192761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).