N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide

C19H21FN2O4S — CID 9164199

IUPACN-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1F
InChIInChI=1S/C19H21FN2O4S/c1-26-17-9-5-4-8-16(17)22-27(24,25)18-12-13(10-11-15(18)20)19(23)21-14-6-2-3-7-14/h4-5,8-12,14,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyVMXPUGQIOJDBCJ-UHFFFAOYSA-N
MW392.45 g/mol
LogP3.31
Rot. Bonds6

About N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide

N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide (PubChem CID 9164199) has the molecular formula C19H21FN2O4S and a molecular weight of 392.45 g/mol. Its IUPAC name is N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide
PubChem CID9164199
Molecular FormulaC19H21FN2O4S
Molecular Weight392.45 g/mol
Exact Mass392.12
IUPAC NameN-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1F
InChIInChI=1S/C19H21FN2O4S/c1-26-17-9-5-4-8-16(17)22-27(24,25)18-12-13(10-11-15(18)20)19(23)21-14-6-2-3-7-14/h4-5,8-12,14,22H,2-3,6-7H2,1H3,(H,21,23)
InChIKeyVMXPUGQIOJDBCJ-UHFFFAOYSA-N
XLogP3.31
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.45
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 7908217
N-cyclopentyl-4-fluoro-3-methoxybenzamide
CID 80948074
N-cyclopentyl-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 2223474
4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]-N-(pyridin-2-ylmethyl)benzamide
CID 9414636
4-chloro-3-[(2-chlorophenyl)sulfamoyl]-N-cyclopentylbenzamide
CID 9214869
N-cyclopentyl-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 9164185
N-cyclohexyl-4-methoxy-3-(quinolin-3-ylsulfamoyl)benzamide
CID 56684157
N-cyclohexyl-4-methoxy-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 46556722
5-amino-2-fluoro-N-(2-methoxyphenyl)benzenesulfonamide
CID 43255479
4-methoxy-3-[(2-methoxyphenyl)sulfamoyl]benzoic acid
CID 777278
N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-3-[(2-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 96517593
N-cycloheptyl-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 71903641

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide (CID 9164199) is N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide is COc1ccccc1NS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1F.
What is the InChIKey of N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The InChIKey is VMXPUGQIOJDBCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O4S/c1-26-17-9-5-4-8-16(17)22-27(24,25)18-12-13(10-11-15(18)20)19(23)21-14-6-2-3-7-14/h4-5,8-12,14,22H,2-3,6-7H2,1H3,(H,21,23).
What are the key properties of N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide has a molecular weight of 392.45 g/mol, XLogP of 3.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-fluoro-3-[(2-methoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 9164199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).