3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide

C22H20N2O3S — CID 8699331

IUPAC3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)c1
InChIInChI=1S/C22H20N2O3S/c1-24(2)28(26,27)19-8-5-7-17(13-19)22(25)23-18-11-10-16-12-15-6-3-4-9-20(15)21(16)14-18/h3-11,13-14H,12H2,1-2H3,(H,23,25)
InChIKeyPBMUQBWYKHRZEO-UHFFFAOYSA-N
MW392.48 g/mol
LogP3.76
Rot. Bonds4

About 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide

3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide (PubChem CID 8699331) has the molecular formula C22H20N2O3S and a molecular weight of 392.48 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide
PubChem CID8699331
Molecular FormulaC22H20N2O3S
Molecular Weight392.48 g/mol
Exact Mass392.12
IUPAC Name3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)c1
InChIInChI=1S/C22H20N2O3S/c1-24(2)28(26,27)19-8-5-7-17(13-19)22(25)23-18-11-10-16-12-15-6-3-4-9-20(15)21(16)14-18/h3-11,13-14H,12H2,1-2H3,(H,23,25)
InChIKeyPBMUQBWYKHRZEO-UHFFFAOYSA-N
XLogP3.76
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126
N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2221562
3-(dimethylsulfamoyl)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 4800647
N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3-(dimethylsulfamoyl)benzamide
CID 100625475
3-(dimethylsulfamoyl)-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 100624777
4-cyano-N-(9H-fluoren-3-yl)benzamide
CID 8699343
3-(cyclopropanecarbonylamino)-N-(9H-fluoren-2-yl)benzamide
CID 34074777
N-(6-bromo-3-pyridinyl)-3-(dimethylsulfamoyl)benzamide
CID 110614688
3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 2221549
3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
CID 110425651
3-(2,2-dimethylpropanoylamino)-N-[6-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]-9H-fluoren-3-yl]benzamide
CID 2849840
N-[3-(dimethylsulfamoyl)phenyl]-3-nitrobenzamide
CID 9093681

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide (CID 8699331) is 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc3c(c2)-c2ccccc2C3)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide?
The InChIKey is PBMUQBWYKHRZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3S/c1-24(2)28(26,27)19-8-5-7-17(13-19)22(25)23-18-11-10-16-12-15-6-3-4-9-20(15)21(16)14-18/h3-11,13-14H,12H2,1-2H3,(H,23,25).
What are the key properties of 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide?
3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide has a molecular weight of 392.48 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(9H-fluoren-3-yl)benzamide is sourced from PubChem (CID 8699331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).