N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide

C15H25N3O3S — CID 95264638

IUPACN,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide
SMILESCN1CCCC[C@H]1CCn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C15H25N3O3S/c1-16(2)22(20,21)14-7-8-15(19)18(12-14)11-9-13-6-4-5-10-17(13)3/h7-8,12-13H,4-6,9-11H2,1-3H3/t13-/m0/s1
InChIKeyFUEUUKZCBZBZKA-ZDUSSCGKSA-N
MW327.45 g/mol
LogP0.97
Rot. Bonds5

About N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide

N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide (PubChem CID 95264638) has the molecular formula C15H25N3O3S and a molecular weight of 327.45 g/mol. Its IUPAC name is N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide
PubChem CID95264638
Molecular FormulaC15H25N3O3S
Molecular Weight327.45 g/mol
Exact Mass327.16
IUPAC NameN,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide
SMILESCN1CCCC[C@H]1CCn1cc(S(=O)(=O)N(C)C)ccc1=O
InChIInChI=1S/C15H25N3O3S/c1-16(2)22(20,21)14-7-8-15(19)18(12-14)11-9-13-6-4-5-10-17(13)3/h7-8,12-13H,4-6,9-11H2,1-3H3/t13-/m0/s1
InChIKeyFUEUUKZCBZBZKA-ZDUSSCGKSA-N
XLogP0.97
TPSA62.62 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(azepan-1-yl)-2-oxoethyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide
CID 7828944
N,N-dimethyl-2-[2-(1-methylpiperidin-2-yl)ethylsulfanyl]-1,3-benzoxazole-5-sulfonamide
CID 112786832
(2S)-1-methyl-2-[2-(4-methylsulfonylphenyl)ethyl]piperidine
CID 97130537
N,N-dimethyl-6-oxo-1-(2-thiophen-2-ylethyl)pyridine-3-sulfonamide
CID 51103389
5-amino-1-[2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]ethyl]pyridin-2-one
CID 79304227
N,N-dimethyl-1-(piperidin-1-ylmethyl)-6-sulfanylidenepyridine-3-sulfonamide
CID 32772373
2-[2-(4-fluorophenyl)sulfonylethyl]-1-methylpiperidine
CID 114015298
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[[(1S,2R)-2-methylcyclohexyl]carbamoyl]acetamide
CID 7829056
1-[2-(1-adamantyl)-2-oxoethyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide
CID 24530870
1-[2-(2,5-dimethylphenoxy)ethyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide
CID 26963059
N,N-dimethyl-6-oxo-1-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]pyridine-3-sulfonamide
CID 9244801
5-amino-1-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-one
CID 165482076

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide?
The IUPAC name of N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide (CID 95264638) is N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide.
What is the SMILES notation for N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide?
The canonical SMILES for N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide is CN1CCCC[C@H]1CCn1cc(S(=O)(=O)N(C)C)ccc1=O.
What is the InChIKey of N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide?
The InChIKey is FUEUUKZCBZBZKA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H25N3O3S/c1-16(2)22(20,21)14-7-8-15(19)18(12-14)11-9-13-6-4-5-10-17(13)3/h7-8,12-13H,4-6,9-11H2,1-3H3/t13-/m0/s1.
What are the key properties of N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide?
N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide has a molecular weight of 327.45 g/mol, XLogP of 0.97, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-oxopyridine-3-sulfonamide is sourced from PubChem (CID 95264638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).