N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide

C19H17ClN2O2S — CID 110360985

IUPACN-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C19H17ClN2O2S/c20-18-9-4-10-19(12-18)22(14-17-8-5-11-21-13-17)25(23,24)15-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKeyDMESBWMYASYWBV-UHFFFAOYSA-N
MW372.88 g/mol
LogP4.27
Rot. Bonds6

About N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide

N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (PubChem CID 110360985) has the molecular formula C19H17ClN2O2S and a molecular weight of 372.88 g/mol. Its IUPAC name is N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
PubChem CID110360985
Molecular FormulaC19H17ClN2O2S
Molecular Weight372.88 g/mol
Exact Mass372.07
IUPAC NameN-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C19H17ClN2O2S/c20-18-9-4-10-19(12-18)22(14-17-8-5-11-21-13-17)25(23,24)15-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKeyDMESBWMYASYWBV-UHFFFAOYSA-N
XLogP4.27
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.88
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360866
N-(4-chlorophenyl)-1-(3-cyanophenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 60539973
N-(3-methylphenyl)-2-phenyl-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 110360388
ethane;N-(3-phenoxyphenyl)-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 91055403
N-[3-(phenoxymethyl)phenyl]-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 23521708
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-(3-methoxyphenyl)-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 110360546
N-(3-methoxyphenyl)-3-phenyl-N-(pyridin-3-ylmethyl)propane-1-sulfonamide
CID 110360575
N-(4-fluorophenyl)-1-(4-methylphenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360869
N-[3-(dimethylamino)phenyl]-2,2,2-trifluoro-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 90872302
5-chloro-N-phenyl-N-(pyridin-3-ylmethyl)thiophene-2-sulfonamide
CID 110360283

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The IUPAC name of N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (CID 110360985) is N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is O=S(=O)(Cc1ccccc1)N(Cc1cccnc1)c1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The InChIKey is DMESBWMYASYWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O2S/c20-18-9-4-10-19(12-18)22(14-17-8-5-11-21-13-17)25(23,24)15-16-6-2-1-3-7-16/h1-13H,14-15H2.
What are the key properties of N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide has a molecular weight of 372.88 g/mol, XLogP of 4.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is sourced from PubChem (CID 110360985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).