N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide

C14H22N2O5S — CID 4224

IUPACN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide
SMILESCCCC(C)N(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C14H22N2O5S/c1-4-5-11(2)16(10-14(17)15-18)22(19,20)13-8-6-12(21-3)7-9-13/h6-9,11,18H,4-5,10H2,1-3H3,(H,15,17)
InChIKeySOWTUVGDQUZPJS-UHFFFAOYSA-N
MW330.41 g/mol
LogP1.38
Rot. Bonds8

About N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide

N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide (PubChem CID 4224) has the molecular formula C14H22N2O5S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide
PubChem CID4224
Molecular FormulaC14H22N2O5S
Molecular Weight330.41 g/mol
Exact Mass330.12
IUPAC NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide
SMILESCCCC(C)N(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C14H22N2O5S/c1-4-5-11(2)16(10-14(17)15-18)22(19,20)13-8-6-12(21-3)7-9-13/h6-9,11,18H,4-5,10H2,1-3H3,(H,15,17)
InChIKeySOWTUVGDQUZPJS-UHFFFAOYSA-N
XLogP1.38
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(1-piperidin-2-ylethyl)amino]acetamide
CID 22907189
2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
CID 10807240
(2R)-2-[2-aminoethyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-3-methylbutanamide
CID 144510795
2-(N-(4-fluorophenyl)sulfonyl-4-methoxyanilino)-N-[(2R)-pentan-2-yl]acetamide
CID 126346344
2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)-N-[(2S)-pentan-2-yl]acetamide
CID 126415763
(2S)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]pentanamide
CID 177375287
(2R)-2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxypropanamide
CID 10594938
3-[[1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-(4-methoxyphenyl)sulfonylamino]propanoic acid
CID 22612442
2-[1-adamantyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
CID 71462975
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]acetamide
CID 10760373
N'-hydroxy-2-[(4-methoxyphenyl)sulfonyl-propan-2-ylamino]ethanimidamide
CID 77044628
2-[[4-(1-ethoxyethoxy)phenyl]sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide
CID 22907178

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide?
The IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide (CID 4224) is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide.
What is the SMILES notation for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide?
The canonical SMILES for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide is CCCC(C)N(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1.
What is the InChIKey of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide?
The InChIKey is SOWTUVGDQUZPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O5S/c1-4-5-11(2)16(10-14(17)15-18)22(19,20)13-8-6-12(21-3)7-9-13/h6-9,11,18H,4-5,10H2,1-3H3,(H,15,17).
What are the key properties of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide?
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide has a molecular weight of 330.41 g/mol, XLogP of 1.38, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-pentan-2-ylamino]acetamide is sourced from PubChem (CID 4224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).