N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide

C18H22N2O4S — CID 45269631

IUPACN-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide
SMILESCC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-14(2)12-20(13-18(21)19-22)25(23,24)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,14,22H,12-13H2,1-2H3,(H,19,21)
InChIKeyPZJJOMPTIHBGHO-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.51
Rot. Bonds7

About N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide

N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide (PubChem CID 45269631) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide
PubChem CID45269631
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide
SMILESCC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22N2O4S/c1-14(2)12-20(13-18(21)19-22)25(23,24)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,14,22H,12-13H2,1-2H3,(H,19,21)
InChIKeyPZJJOMPTIHBGHO-UHFFFAOYSA-N
XLogP2.51
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide (CID 45269631) is N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide is CC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide?
The InChIKey is PZJJOMPTIHBGHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-14(2)12-20(13-18(21)19-22)25(23,24)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11,14,22H,12-13H2,1-2H3,(H,19,21).
What are the key properties of N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide?
N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide has a molecular weight of 362.45 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 45269631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).