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

C14H16N2O2S — CID 47121805

IUPACN-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESCN(Cc1cccnc1)S(=O)(=O)Cc1ccccc1
InChIInChI=1S/C14H16N2O2S/c1-16(11-14-8-5-9-15-10-14)19(17,18)12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
InChIKeyKYDYHVADELXGSK-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.04
Rot. Bonds5

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

N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (PubChem CID 47121805) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
PubChem CID47121805
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESCN(Cc1cccnc1)S(=O)(=O)Cc1ccccc1
InChIInChI=1S/C14H16N2O2S/c1-16(11-14-8-5-9-15-10-14)19(17,18)12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3
InChIKeyKYDYHVADELXGSK-UHFFFAOYSA-N
XLogP2.04
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(4-methylphenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110724733
N-methyl-3-phenyl-N-(pyridin-3-ylmethyl)propane-1-sulfonamide
CID 110724741
N-methyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 58150961
2-[methyl(pyridin-3-ylmethyl)sulfamoyl]benzoic acid
CID 43471408
N-ethyl-N-[methyl(pyridin-3-ylmethyl)sulfamoyl]ethanamine
CID 86916823
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 86922552
N-methyl-1-phenyl-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]methanesulfonamide
CID 71977773
N-(4-fluorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360866
N-ethyl-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 174517903
N-methyl-N-[methyl(pyridin-3-ylmethyl)sulfamoyl]butan-1-amine
CID 86931183
N-(3-chlorophenyl)-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide
CID 110360985
N-methyl-9,10-dioxo-N-(pyridin-3-ylmethyl)anthracene-1-sulfonamide
CID 3853066

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The IUPAC name of N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide (CID 47121805) is N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The canonical SMILES for N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is CN(Cc1cccnc1)S(=O)(=O)Cc1ccccc1.
What is the InChIKey of N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
The InChIKey is KYDYHVADELXGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-16(11-14-8-5-9-15-10-14)19(17,18)12-13-6-3-2-4-7-13/h2-10H,11-12H2,1H3.
What are the key properties of N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide?
N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide has a molecular weight of 276.36 g/mol, XLogP of 2.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenyl-N-(pyridin-3-ylmethyl)methanesulfonamide is sourced from PubChem (CID 47121805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).