5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide

C18H17Cl2FN2O3S — CID 4190475

IUPAC5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cc(S(=O)(=O)NC2CCCC2)ccc1F
InChIInChI=1S/C18H17Cl2FN2O3S/c19-11-7-12(20)9-14(8-11)22-18(24)16-10-15(5-6-17(16)21)27(25,26)23-13-3-1-2-4-13/h5-10,13,23H,1-4H2,(H,22,24)
InChIKeyCOIGKRMQVNURRO-UHFFFAOYSA-N
MW431.32 g/mol
LogP4.61
Rot. Bonds5

About 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide

5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide (PubChem CID 4190475) has the molecular formula C18H17Cl2FN2O3S and a molecular weight of 431.32 g/mol. Its IUPAC name is 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
PubChem CID4190475
Molecular FormulaC18H17Cl2FN2O3S
Molecular Weight431.32 g/mol
Exact Mass430.03
IUPAC Name5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1cc(S(=O)(=O)NC2CCCC2)ccc1F
InChIInChI=1S/C18H17Cl2FN2O3S/c19-11-7-12(20)9-14(8-11)22-18(24)16-10-15(5-6-17(16)21)27(25,26)23-13-3-1-2-4-13/h5-10,13,23H,1-4H2,(H,22,24)
InChIKeyCOIGKRMQVNURRO-UHFFFAOYSA-N
XLogP4.61
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.32
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide?
The IUPAC name of 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide (CID 4190475) is 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide.
What is the SMILES notation for 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide?
The canonical SMILES for 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1cc(S(=O)(=O)NC2CCCC2)ccc1F.
What is the InChIKey of 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide?
The InChIKey is COIGKRMQVNURRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2FN2O3S/c19-11-7-12(20)9-14(8-11)22-18(24)16-10-15(5-6-17(16)21)27(25,26)23-13-3-1-2-4-13/h5-10,13,23H,1-4H2,(H,22,24).
What are the key properties of 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide?
5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide has a molecular weight of 431.32 g/mol, XLogP of 4.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide is sourced from PubChem (CID 4190475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).