2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide

C16H19N3O3S — CID 86820814

IUPAC2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1ccc(NS(C)(=O)=O)c(C(=O)NCc2cccc(C)n2)c1
InChIInChI=1S/C16H19N3O3S/c1-11-7-8-15(19-23(3,21)22)14(9-11)16(20)17-10-13-6-4-5-12(2)18-13/h4-9,19H,10H2,1-3H3,(H,17,20)
InChIKeyGKNBCBYWADCEPQ-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.00
Rot. Bonds5

About 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide

2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide (PubChem CID 86820814) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
PubChem CID86820814
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC Name2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1ccc(NS(C)(=O)=O)c(C(=O)NCc2cccc(C)n2)c1
InChIInChI=1S/C16H19N3O3S/c1-11-7-8-15(19-23(3,21)22)14(9-11)16(20)17-10-13-6-4-5-12(2)18-13/h4-9,19H,10H2,1-3H3,(H,17,20)
InChIKeyGKNBCBYWADCEPQ-UHFFFAOYSA-N
XLogP2.00
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62510285
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 87041318
2,5-dihydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 103892127
N-[(6-methyl-2-pyridinyl)methyl]-2-propan-2-ylsulfonylbenzamide
CID 86820820
2-amino-3-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62321573
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]-5-nitrobenzamide
CID 86852927
5-methyl-2-[(6-methyl-2-pyridinyl)methylamino]benzenecarbothioamide
CID 107928888
4-amino-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1H-pyrazole-3-carboxamide
CID 62323870
2-bromo-N-[(6-methyl-2-pyridinyl)methyl]furan-3-carboxamide
CID 106853869
2-(methanesulfonamido)-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 51097784
4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62307538
3-fluoro-2-(methylamino)-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62662132

Frequently Asked Questions

What is the IUPAC name of 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The IUPAC name of 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide (CID 86820814) is 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The canonical SMILES for 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide is Cc1ccc(NS(C)(=O)=O)c(C(=O)NCc2cccc(C)n2)c1.
What is the InChIKey of 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The InChIKey is GKNBCBYWADCEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c1-11-7-8-15(19-23(3,21)22)14(9-11)16(20)17-10-13-6-4-5-12(2)18-13/h4-9,19H,10H2,1-3H3,(H,17,20).
What are the key properties of 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide has a molecular weight of 333.41 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methanesulfonamido)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide is sourced from PubChem (CID 86820814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).