2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide

C15H22N2O5S — CID 10807240

IUPAC2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NO)C2CCCCC2)cc1
InChIInChI=1S/C15H22N2O5S/c1-22-13-7-9-14(10-8-13)23(20,21)17(11-15(18)16-19)12-5-3-2-4-6-12/h7-10,12,19H,2-6,11H2,1H3,(H,16,18)
InChIKeyJUSOSBKBFCYTPA-UHFFFAOYSA-N
MW342.42 g/mol
LogP1.52
Rot. Bonds6

About 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide

2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide (PubChem CID 10807240) has the molecular formula C15H22N2O5S and a molecular weight of 342.42 g/mol. Its IUPAC name is 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
PubChem CID10807240
Molecular FormulaC15H22N2O5S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC Name2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)NO)C2CCCCC2)cc1
InChIInChI=1S/C15H22N2O5S/c1-22-13-7-9-14(10-8-13)23(20,21)17(11-15(18)16-19)12-5-3-2-4-6-12/h7-10,12,19H,2-6,11H2,1H3,(H,16,18)
InChIKeyJUSOSBKBFCYTPA-UHFFFAOYSA-N
XLogP1.52
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 51.52
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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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide?
The IUPAC name of 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide (CID 10807240) is 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide.
What is the SMILES notation for 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide?
The canonical SMILES for 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide is COc1ccc(S(=O)(=O)N(CC(=O)NO)C2CCCCC2)cc1.
What is the InChIKey of 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide?
The InChIKey is JUSOSBKBFCYTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5S/c1-22-13-7-9-14(10-8-13)23(20,21)17(11-15(18)16-19)12-5-3-2-4-6-12/h7-10,12,19H,2-6,11H2,1H3,(H,16,18).
What are the key properties of 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide?
2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide has a molecular weight of 342.42 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxyacetamide is sourced from PubChem (CID 10807240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).