N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide

C17H21N3O4S — CID 53161459

IUPACN,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)N(C)C)c2=O)cc1
InChIInChI=1S/C17H21N3O4S/c1-12-5-8-14(9-6-12)25(23,24)18-15-10-7-13(2)20(17(15)22)11-16(21)19(3)4/h5-10,18H,11H2,1-4H3
InChIKeyFTKVTOVBVIFHMG-UHFFFAOYSA-N
MW363.44 g/mol
LogP1.35
Rot. Bonds5

About N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide

N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide (PubChem CID 53161459) has the molecular formula C17H21N3O4S and a molecular weight of 363.44 g/mol. Its IUPAC name is N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide
PubChem CID53161459
Molecular FormulaC17H21N3O4S
Molecular Weight363.44 g/mol
Exact Mass363.13
IUPAC NameN,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)N(C)C)c2=O)cc1
InChIInChI=1S/C17H21N3O4S/c1-12-5-8-14(9-6-12)25(23,24)18-15-10-7-13(2)20(17(15)22)11-16(21)19(3)4/h5-10,18H,11H2,1-4H3
InChIKeyFTKVTOVBVIFHMG-UHFFFAOYSA-N
XLogP1.35
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide (CID 53161459) is N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide is Cc1ccc(S(=O)(=O)Nc2ccc(C)n(CC(=O)N(C)C)c2=O)cc1.
What is the InChIKey of N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide?
The InChIKey is FTKVTOVBVIFHMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O4S/c1-12-5-8-14(9-6-12)25(23,24)18-15-10-7-13(2)20(17(15)22)11-16(21)19(3)4/h5-10,18H,11H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide?
N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide has a molecular weight of 363.44 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[6-methyl-3-[(4-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 53161459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).