1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide

C16H23FN4O4S — CID 92684224

IUPAC1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N(CC(=O)N1CCC(C(N)=O)CC1)c1ccccc1F
InChIInChI=1S/C16H23FN4O4S/c1-19(2)26(24,25)21(14-6-4-3-5-13(14)17)11-15(22)20-9-7-12(8-10-20)16(18)23/h3-6,12H,7-11H2,1-2H3,(H2,18,23)
InChIKeyMOVOYOINYRORDL-UHFFFAOYSA-N
MW386.45 g/mol
LogP0.16
Rot. Bonds6

About 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide

1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide (PubChem CID 92684224) has the molecular formula C16H23FN4O4S and a molecular weight of 386.45 g/mol. Its IUPAC name is 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide
PubChem CID92684224
Molecular FormulaC16H23FN4O4S
Molecular Weight386.45 g/mol
Exact Mass386.14
IUPAC Name1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N(CC(=O)N1CCC(C(N)=O)CC1)c1ccccc1F
InChIInChI=1S/C16H23FN4O4S/c1-19(2)26(24,25)21(14-6-4-3-5-13(14)17)11-15(22)20-9-7-12(8-10-20)16(18)23/h3-6,12H,7-11H2,1-2H3,(H2,18,23)
InChIKeyMOVOYOINYRORDL-UHFFFAOYSA-N
XLogP0.16
TPSA104.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2-fluoro-N-methylsulfonylanilino)acetyl]piperidine-4-carboxamide
CID 126031859
1-[2-(N-(3,4-dimethoxyphenyl)sulfonyl-2-fluoroanilino)acetyl]piperidine-4-carboxamide
CID 30267622
1-[2-(2-fluoro-N-thiophen-2-ylsulfonylanilino)acetyl]piperidine-4-carboxamide
CID 30267650
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-1-(4-phenylpiperazin-1-yl)ethanone
CID 53283438
1-[2-[methylsulfonyl(naphthalen-1-yl)amino]acetyl]piperidine-4-carboxamide
CID 126035425
1-[2-[N-(benzenesulfonyl)-4-chloro-2-methylanilino]acetyl]piperidine-4-carboxamide
CID 126031541
ethyl 1-[2-[N-(dimethylsulfamoyl)anilino]acetyl]piperidine-4-carboxylate
CID 6456631
2-[N-(dimethylsulfamoyl)anilino]-1-pyrrolidin-1-ylethanone
CID 1289654
1-[2-(2,4,5-trichloro-N-methylsulfonylanilino)acetyl]piperidine-4-carboxamide
CID 1251616
1-[2-(N-methylsulfonyl-4-phenoxyanilino)acetyl]piperidine-4-carboxamide
CID 2928967
1-[2-[(2-bromophenyl)methyl-methylamino]acetyl]piperidine-4-carboxamide
CID 78787606
2-[N-(dimethylsulfamoyl)-2-fluoroanilino]-N-[3-(2-ethylpiperidin-1-yl)propyl]acetamide
CID 43905897

Frequently Asked Questions

What is the IUPAC name of 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide (CID 92684224) is 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide is CN(C)S(=O)(=O)N(CC(=O)N1CCC(C(N)=O)CC1)c1ccccc1F.
What is the InChIKey of 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide?
The InChIKey is MOVOYOINYRORDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN4O4S/c1-19(2)26(24,25)21(14-6-4-3-5-13(14)17)11-15(22)20-9-7-12(8-10-20)16(18)23/h3-6,12H,7-11H2,1-2H3,(H2,18,23).
What are the key properties of 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide?
1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 0.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[N-(dimethylsulfamoyl)-2-fluoroanilino]acetyl]piperidine-4-carboxamide is sourced from PubChem (CID 92684224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).