3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide

C20H18FN3O3S — CID 24642262

IUPAC3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1cccnc1
InChIInChI=1S/C20H18FN3O3S/c1-14(16-7-5-11-22-13-16)23-20(25)15-6-4-8-17(12-15)28(26,27)24-19-10-3-2-9-18(19)21/h2-14,24H,1H3,(H,23,25)
InChIKeyHRMGVTZUSGYYOM-UHFFFAOYSA-N
MW399.45 g/mol
LogP3.51
Rot. Bonds6

About 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide

3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide (PubChem CID 24642262) has the molecular formula C20H18FN3O3S and a molecular weight of 399.45 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide.

Molecular Properties

Compound Name3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide
PubChem CID24642262
Molecular FormulaC20H18FN3O3S
Molecular Weight399.45 g/mol
Exact Mass399.11
IUPAC Name3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide
SMILESCC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1cccnc1
InChIInChI=1S/C20H18FN3O3S/c1-14(16-7-5-11-22-13-16)23-20(25)15-6-4-8-17(12-15)28(26,27)24-19-10-3-2-9-18(19)21/h2-14,24H,1H3,(H,23,25)
InChIKeyHRMGVTZUSGYYOM-UHFFFAOYSA-N
XLogP3.51
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 40790771
3-(dimethylsulfamoyl)-N-(1-pyridin-3-ylethyl)benzamide
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3-[(2-fluorophenyl)sulfamoyl]-N-(1-hydroxypropan-2-yl)benzamide
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3-(azepan-1-ylsulfonyl)-N-(1-pyridin-3-ylethyl)benzamide
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3,4-difluoro-N-(1-pyridin-3-ylethyl)benzamide
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3-(1-pyridin-3-ylethylcarbamoyl)benzoic acid
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3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
CID 132667869
N-(4-fluoro-3-methylphenyl)-3-(1-pyridin-3-ylethylsulfamoyl)benzamide
CID 90075293
4-amino-3-fluoro-N-[(1S)-1-pyridin-3-ylethyl]benzamide
CID 81404468
N-(2-fluorophenyl)-3-(1-phenylethylsulfamoyl)benzamide
CID 109064640

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide?
The IUPAC name of 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide (CID 24642262) is 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide.
What is the SMILES notation for 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide?
The canonical SMILES for 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide is CC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1cccnc1.
What is the InChIKey of 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide?
The InChIKey is HRMGVTZUSGYYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3S/c1-14(16-7-5-11-22-13-16)23-20(25)15-6-4-8-17(12-15)28(26,27)24-19-10-3-2-9-18(19)21/h2-14,24H,1H3,(H,23,25).
What are the key properties of 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide?
3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide has a molecular weight of 399.45 g/mol, XLogP of 3.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)sulfamoyl]-N-(1-pyridin-3-ylethyl)benzamide is sourced from PubChem (CID 24642262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).