N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide

C19H24N4O4S — CID 142683259

IUPACN-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide
SMILESCCCCCN(CC(=O)NO)S(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C19H24N4O4S/c1-2-3-7-14-23(15-19(24)22-25)28(26,27)18-12-10-17(11-13-18)21-20-16-8-5-4-6-9-16/h4-6,8-13,25H,2-3,7,14-15H2,1H3,(H,22,24)/b21-20+
InChIKeyGRKUWBQYPAWDHL-QZQOTICOSA-N
MW404.49 g/mol
LogP3.79
Rot. Bonds10

About N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide

N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide (PubChem CID 142683259) has the molecular formula C19H24N4O4S and a molecular weight of 404.49 g/mol. Its IUPAC name is N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide
PubChem CID142683259
Molecular FormulaC19H24N4O4S
Molecular Weight404.49 g/mol
Exact Mass404.15
IUPAC NameN-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide
SMILESCCCCCN(CC(=O)NO)S(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C19H24N4O4S/c1-2-3-7-14-23(15-19(24)22-25)28(26,27)18-12-10-17(11-13-18)21-20-16-8-5-4-6-9-16/h4-6,8-13,25H,2-3,7,14-15H2,1H3,(H,22,24)/b21-20+
InChIKeyGRKUWBQYPAWDHL-QZQOTICOSA-N
XLogP3.79
TPSA111.43 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(4-butylphenyl)sulfonyl-pentylamino]-N-hydroxyacetamide
CID 142683333
2-[(4-acetamidophenyl)sulfonyl-pentylamino]-N-hydroxyacetamide
CID 142683353
2-[hexyl(naphthalen-2-ylsulfonyl)amino]-N-hydroxyacetamide
CID 143926016
2-[(4-aminophenyl)sulfonyl-butylamino]-N-hydroxyacetamide
CID 141159834
N-hydroxy-2-[(4-methylphenyl)sulfonyl-(2-phenylethyl)amino]acetamide
CID 59105580
4-(dipropylsulfamoyl)-N-(4-phenyldiazenylphenyl)benzamide
CID 3597493
3-[(4-chlorophenyl)sulfonyl-pentylamino]-N-hydroxypropanamide
CID 142683275
N-hydroxy-2-[pentyl-[3-(trifluoromethoxy)phenyl]sulfonylamino]acetamide
CID 142683284
N-hydroxy-3-[pentyl-(4-propylphenyl)sulfonylamino]propanamide
CID 142683345
2-[benzenesulfonyl(pentyl)amino]-N-(1,3-thiazol-2-yl)acetamide
CID 4087394
2-[(4-bromophenyl)sulfonyl-(2-phenylethyl)amino]-N-butylacetamide
CID 126064929
2-[hexadecylsulfonyl(2-phenylethyl)amino]-N-hydroxyacetamide
CID 54222909

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide (CID 142683259) is N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide is CCCCCN(CC(=O)NO)S(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1.
What is the InChIKey of N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide?
The InChIKey is GRKUWBQYPAWDHL-QZQOTICOSA-N. The full InChI is InChI=1S/C19H24N4O4S/c1-2-3-7-14-23(15-19(24)22-25)28(26,27)18-12-10-17(11-13-18)21-20-16-8-5-4-6-9-16/h4-6,8-13,25H,2-3,7,14-15H2,1H3,(H,22,24)/b21-20+.
What are the key properties of N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide?
N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide has a molecular weight of 404.49 g/mol, XLogP of 3.79, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[pentyl-(4-phenyldiazenylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 142683259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).