1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide

C14H15ClN2O3S — CID 110730618

IUPAC1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide
SMILESCn1cc(CNS(=O)(=O)Cc2ccccc2Cl)ccc1=O
InChIInChI=1S/C14H15ClN2O3S/c1-17-9-11(6-7-14(17)18)8-16-21(19,20)10-12-4-2-3-5-13(12)15/h2-7,9,16H,8,10H2,1H3
InChIKeyFBLHDGGXLDWNKL-UHFFFAOYSA-N
MW326.81 g/mol
LogP1.66
Rot. Bonds5

About 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide

1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide (PubChem CID 110730618) has the molecular formula C14H15ClN2O3S and a molecular weight of 326.81 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide
PubChem CID110730618
Molecular FormulaC14H15ClN2O3S
Molecular Weight326.81 g/mol
Exact Mass326.05
IUPAC Name1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide
SMILESCn1cc(CNS(=O)(=O)Cc2ccccc2Cl)ccc1=O
InChIInChI=1S/C14H15ClN2O3S/c1-17-9-11(6-7-14(17)18)8-16-21(19,20)10-12-4-2-3-5-13(12)15/h2-7,9,16H,8,10H2,1H3
InChIKeyFBLHDGGXLDWNKL-UHFFFAOYSA-N
XLogP1.66
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.81
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methyl-6-oxo-3-pyridinyl)methyl]-1-(4-methylphenyl)methanesulfonamide
CID 110730616
1-(2-chlorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]methanesulfonamide
CID 46772712
N-[(1-methyl-6-oxo-3-pyridinyl)methyl]thiophene-2-sulfonamide
CID 110730606
1-(2-chlorophenyl)-N-(2-methylpropyl)methanesulfonamide
CID 17257571
1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
CID 120824558
1-(2-chlorophenyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 2988708
1-(2-chlorophenyl)-N-(3-hydroxybutyl)methanesulfonamide
CID 111977012
1-(2-chlorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]methanesulfonamide
CID 75518571
1-(2-chlorophenyl)-N-heptylmethanesulfonamide
CID 17257569
1-(2-chlorophenyl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]methanesulfonamide
CID 110739043
1-(2-chlorophenyl)-N-[(2,5-difluorophenyl)methyl]methanesulfonamide
CID 110780996
1-(2-chlorophenyl)-N-[(2,4-difluorophenyl)methyl]methanesulfonamide
CID 110782254

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide (CID 110730618) is 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide is Cn1cc(CNS(=O)(=O)Cc2ccccc2Cl)ccc1=O.
What is the InChIKey of 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide?
The InChIKey is FBLHDGGXLDWNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O3S/c1-17-9-11(6-7-14(17)18)8-16-21(19,20)10-12-4-2-3-5-13(12)15/h2-7,9,16H,8,10H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide?
1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide has a molecular weight of 326.81 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]methanesulfonamide is sourced from PubChem (CID 110730618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).