N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide

C17H19FN2O4S — CID 87026681

IUPACN-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1C
InChIInChI=1S/C17H19FN2O4S/c1-10-8-17(11(2)7-16(10)24-4)25(22,23)20-13-5-6-14(18)15(9-13)19-12(3)21/h5-9,20H,1-4H3,(H,19,21)
InChIKeyLTNHBVUULVZPNG-UHFFFAOYSA-N
MW366.41 g/mol
LogP3.21
Rot. Bonds5

About N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide

N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 87026681) has the molecular formula C17H19FN2O4S and a molecular weight of 366.41 g/mol. Its IUPAC name is N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide
PubChem CID87026681
Molecular FormulaC17H19FN2O4S
Molecular Weight366.41 g/mol
Exact Mass366.10
IUPAC NameN-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1C
InChIInChI=1S/C17H19FN2O4S/c1-10-8-17(11(2)7-16(10)24-4)25(22,23)20-13-5-6-14(18)15(9-13)19-12(3)21/h5-9,20H,1-4H3,(H,19,21)
InChIKeyLTNHBVUULVZPNG-UHFFFAOYSA-N
XLogP3.21
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(2-bromo-4,5-dimethoxyphenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 30668145
N-[5-[(2,5-dimethylphenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 24656726
3-[(3-acetamido-4-fluorophenyl)sulfamoyl]-4-methoxybenzoic acid
CID 24656737
N-[5-[(3-bromo-4-methoxyphenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 24656740
N-(2-fluorophenyl)-4-methoxy-2,5-dimethylbenzenesulfonamide
CID 2236619
N-[2-fluoro-5-[(4-methoxyphenyl)sulfonylamino]phenyl]acetamide
CID 46603660
N-[5-[(2,4-difluorophenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 134017686
N-[4-[(2-fluorophenyl)sulfonylamino]-2-methoxyphenyl]acetamide
CID 60527169
N-[5-[(2,5-dichlorophenyl)sulfonylamino]-2-methoxyphenyl]acetamide
CID 31814804
N-[5-[(3,4-difluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514306
N-(4-hydroxyphenyl)-5-methoxy-2,4-dimethylbenzenesulfonamide
CID 146672107
N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 112997944

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide (CID 87026681) is N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide is COc1cc(C)c(S(=O)(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1C.
What is the InChIKey of N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is LTNHBVUULVZPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O4S/c1-10-8-17(11(2)7-16(10)24-4)25(22,23)20-13-5-6-14(18)15(9-13)19-12(3)21/h5-9,20H,1-4H3,(H,19,21).
What are the key properties of N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide?
N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 366.41 g/mol, XLogP of 3.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-5-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 87026681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).