N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide

C19H24N2O5S — CID 10739270

IUPACN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CCCCc2ccccc2)CC(=O)NO)cc1
InChIInChI=1S/C19H24N2O5S/c1-26-17-10-12-18(13-11-17)27(24,25)21(15-19(22)20-23)14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13,23H,5-6,9,14-15H2,1H3,(H,20,22)
InChIKeySKWPMXDILDPKGU-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.21
Rot. Bonds10

About N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide

N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide (PubChem CID 10739270) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide
PubChem CID10739270
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC NameN-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CCCCc2ccccc2)CC(=O)NO)cc1
InChIInChI=1S/C19H24N2O5S/c1-26-17-10-12-18(13-11-17)27(24,25)21(15-19(22)20-23)14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13,23H,5-6,9,14-15H2,1H3,(H,20,22)
InChIKeySKWPMXDILDPKGU-UHFFFAOYSA-N
XLogP2.21
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide?
The IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide (CID 10739270) is N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide.
What is the SMILES notation for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide?
The canonical SMILES for N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide is COc1ccc(S(=O)(=O)N(CCCCc2ccccc2)CC(=O)NO)cc1.
What is the InChIKey of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide?
The InChIKey is SKWPMXDILDPKGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-26-17-10-12-18(13-11-17)27(24,25)21(15-19(22)20-23)14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13,23H,5-6,9,14-15H2,1H3,(H,20,22).
What are the key properties of N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide?
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(4-phenylbutyl)amino]acetamide has a molecular weight of 392.48 g/mol, XLogP of 2.21, 10 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-(4-phenylbutyl)amino]acetamide is sourced from PubChem (CID 10739270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).