N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide

C19H17FN2O2S — CID 110360866

IUPACN-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O2S/c20-18-8-10-19(11-9-18)22(14-17-7-4-12-21-13-17)25(23,24)15-16-5-2-1-3-6-16/h1-13H,14-15H2
InChIKeyOMJIOTYAUUHBTA-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.76
Rot. Bonds6

About N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide

N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (PubChem CID 110360866) has the molecular formula C19H17FN2O2S and a molecular weight of 356.42 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
PubChem CID110360866
Molecular FormulaC19H17FN2O2S
Molecular Weight356.42 g/mol
Exact Mass356.10
IUPAC NameN-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O2S/c20-18-8-10-19(11-9-18)22(14-17-7-4-12-21-13-17)25(23,24)15-16-5-2-1-3-6-16/h1-13H,14-15H2
InChIKeyOMJIOTYAUUHBTA-UHFFFAOYSA-N
XLogP3.76
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-1-(4-methylphenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360869
N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360985
2,2,2-trifluoro-N-phenyl-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 23521664
N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 47121805
N-(4-fluorophenyl)-3,5-dimethyl-N-(pyridin-3-ylmethyl)-1H-pyrazole-4-sulfonamide
CID 110360875
5-ethyl-N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide
CID 110360863
N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 110360446
N-(4-chlorophenyl)-1-(3-cyanophenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 60539973
1-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)-N-(2-thiophen-2-ylethyl)methanesulfonamide
CID 121084962
N-[4-(2-methoxyphenoxy)phenyl]-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 10157712
N-(4-methoxyphenyl)-3-phenyl-N-(pyridin-3-ylmethyl)propane-1-sulfonamide
CID 110360679
N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The IUPAC name of N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (CID 110360866) is N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is O=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The InChIKey is OMJIOTYAUUHBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2S/c20-18-8-10-19(11-9-18)22(14-17-7-4-12-21-13-17)25(23,24)15-16-5-2-1-3-6-16/h1-13H,14-15H2.
What are the key properties of N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide has a molecular weight of 356.42 g/mol, XLogP of 3.76, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is sourced from PubChem (CID 110360866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).