N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide

C23H22N2O3S — CID 25483410

IUPACN-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide
SMILESCS(=O)(=O)NCCc1ccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)cc1
InChIInChI=1S/C23H22N2O3S/c1-29(27,28)24-13-12-16-6-8-17(9-7-16)23(26)25-20-11-10-19-14-18-4-2-3-5-21(18)22(19)15-20/h2-11,15,24H,12-14H2,1H3,(H,25,26)
InChIKeyVZFYGRAEDYZRJL-UHFFFAOYSA-N
MW406.51 g/mol
LogP3.60
Rot. Bonds6

About N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide

N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide (PubChem CID 25483410) has the molecular formula C23H22N2O3S and a molecular weight of 406.51 g/mol. Its IUPAC name is N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide.

Molecular Properties

Compound NameN-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide
PubChem CID25483410
Molecular FormulaC23H22N2O3S
Molecular Weight406.51 g/mol
Exact Mass406.14
IUPAC NameN-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide
SMILESCS(=O)(=O)NCCc1ccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)cc1
InChIInChI=1S/C23H22N2O3S/c1-29(27,28)24-13-12-16-6-8-17(9-7-16)23(26)25-20-11-10-19-14-18-4-2-3-5-21(18)22(19)15-20/h2-11,15,24H,12-14H2,1H3,(H,25,26)
InChIKeyVZFYGRAEDYZRJL-UHFFFAOYSA-N
XLogP3.60
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.51
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(methanesulfonamido)ethyl]-N-(4-phenoxyphenyl)benzamide
CID 27006017
N-(4-acetamidophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 22109501
N-(4-fluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 18100481
4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide
CID 27007439
4-cyano-N-(9H-fluoren-3-yl)benzamide
CID 8699343
3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide
CID 8699331
4-(difluoromethylsulfonyl)-N-(9H-fluoren-2-yl)benzamide
CID 34074909
3-chloro-N-(9H-fluoren-2-yl)-4-methylbenzamide
CID 806714
N-[2-(4-benzoylphenyl)ethyl]methanesulfonamide
CID 110667350
N-(9H-fluoren-2-yl)-1-oxidopyridin-1-ium-4-carboxamide
CID 51154962
N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 17457009
N-(2,4-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 27005483

Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The IUPAC name of N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide (CID 25483410) is N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide.
What is the SMILES notation for N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The canonical SMILES for N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide is CS(=O)(=O)NCCc1ccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)cc1.
What is the InChIKey of N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The InChIKey is VZFYGRAEDYZRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3S/c1-29(27,28)24-13-12-16-6-8-17(9-7-16)23(26)25-20-11-10-19-14-18-4-2-3-5-21(18)22(19)15-20/h2-11,15,24H,12-14H2,1H3,(H,25,26).
What are the key properties of N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide?
N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide has a molecular weight of 406.51 g/mol, XLogP of 3.60, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide is sourced from PubChem (CID 25483410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).