1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide

C17H17FN2O4S — CID 54018993

IUPAC1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide
SMILESO=C(NO)C1(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CCC1
InChIInChI=1S/C17H17FN2O4S/c18-14-6-2-12(3-7-14)13-4-8-15(9-5-13)25(23,24)20-17(10-1-11-17)16(21)19-22/h2-9,20,22H,1,10-11H2,(H,19,21)
InChIKeyKXPJDYSBWNHMTI-UHFFFAOYSA-N
MW364.40 g/mol
LogP2.20
Rot. Bonds5

About 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide

1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide (PubChem CID 54018993) has the molecular formula C17H17FN2O4S and a molecular weight of 364.40 g/mol. Its IUPAC name is 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide
PubChem CID54018993
Molecular FormulaC17H17FN2O4S
Molecular Weight364.40 g/mol
Exact Mass364.09
IUPAC Name1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide
SMILESO=C(NO)C1(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CCC1
InChIInChI=1S/C17H17FN2O4S/c18-14-6-2-12(3-7-14)13-4-8-15(9-5-13)25(23,24)20-17(10-1-11-17)16(21)19-22/h2-9,20,22H,1,10-11H2,(H,19,21)
InChIKeyKXPJDYSBWNHMTI-UHFFFAOYSA-N
XLogP2.20
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.20
H-Bond Donors ≤ 53
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 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide?
The IUPAC name of 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide (CID 54018993) is 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide.
What is the SMILES notation for 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide?
The canonical SMILES for 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide is O=C(NO)C1(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CCC1.
What is the InChIKey of 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide?
The InChIKey is KXPJDYSBWNHMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O4S/c18-14-6-2-12(3-7-14)13-4-8-15(9-5-13)25(23,24)20-17(10-1-11-17)16(21)19-22/h2-9,20,22H,1,10-11H2,(H,19,21).
What are the key properties of 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide?
1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide has a molecular weight of 364.40 g/mol, XLogP of 2.20, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-N-hydroxycyclobutane-1-carboxamide is sourced from PubChem (CID 54018993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).