2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide

C18H20FN3O4S — CID 2594456

IUPAC2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1F)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20FN3O4S/c19-16-3-1-2-4-17(16)27(24,25)20-13-18(23)21-14-5-7-15(8-6-14)22-9-11-26-12-10-22/h1-8,20H,9-13H2,(H,21,23)
InChIKeySBBGUWBXXPNMKW-UHFFFAOYSA-N
MW393.44 g/mol
LogP1.58
Rot. Bonds6

About 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide

2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 2594456) has the molecular formula C18H20FN3O4S and a molecular weight of 393.44 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID2594456
Molecular FormulaC18H20FN3O4S
Molecular Weight393.44 g/mol
Exact Mass393.12
IUPAC Name2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1F)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H20FN3O4S/c19-16-3-1-2-4-17(16)27(24,25)20-13-18(23)21-14-5-7-15(8-6-14)22-9-11-26-12-10-22/h1-8,20H,9-13H2,(H,21,23)
InChIKeySBBGUWBXXPNMKW-UHFFFAOYSA-N
XLogP1.58
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 7938967
3-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 61252883
2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
CID 781635
2-[(2,6-difluorophenyl)sulfonyl-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 17398372
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919
2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
CID 18078616
2-fluoro-N-[2-(5-methyl-1,4-oxazepan-4-yl)-2-oxoethyl]benzenesulfonamide
CID 136543557
2-(2-methylphenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)acetamide
CID 2458170
2-(2-morpholin-4-ylanilino)-N-(4-piperidin-1-ylphenyl)acetamide
CID 109010529
2-amino-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]acetamide
CID 61253868
N-(4-morpholin-4-ylphenyl)-2-(2-propylanilino)acetamide
CID 33171709
4-[(2-fluorophenyl)sulfamoyl]-N-(4-morpholin-4-ylphenyl)benzamide
CID 4785273

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide (CID 2594456) is 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide is O=C(CNS(=O)(=O)c1ccccc1F)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is SBBGUWBXXPNMKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O4S/c19-16-3-1-2-4-17(16)27(24,25)20-13-18(23)21-14-5-7-15(8-6-14)22-9-11-26-12-10-22/h1-8,20H,9-13H2,(H,21,23).
What are the key properties of 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 393.44 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 2594456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).