N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide

C13H16N4O2S — CID 104999383

IUPACN,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NCc2ccncc2)nc1
InChIInChI=1S/C13H16N4O2S/c1-17(2)20(18,19)12-3-4-13(16-10-12)15-9-11-5-7-14-8-6-11/h3-8,10H,9H2,1-2H3,(H,15,16)
InChIKeyZGWCZWRHYXYOCA-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.34
Rot. Bonds5

About N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide

N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide (PubChem CID 104999383) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide
PubChem CID104999383
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC NameN,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NCc2ccncc2)nc1
InChIInChI=1S/C13H16N4O2S/c1-17(2)20(18,19)12-3-4-13(16-10-12)15-9-11-5-7-14-8-6-11/h3-8,10H,9H2,1-2H3,(H,15,16)
InChIKeyZGWCZWRHYXYOCA-UHFFFAOYSA-N
XLogP1.34
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-6-[(3-methyl-4-pyridinyl)methylamino]pyridine-3-sulfonamide
CID 103341074
6-[(3-bromo-4-fluorophenyl)methylamino]-N,N-dimethylpyridine-3-sulfonamide
CID 154860347
N,N-dimethyl-6-(prop-2-ynylamino)pyridine-3-sulfonamide
CID 103340991
6-(ethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-sulfonamide
CID 62150311
N,N-dimethyl-6-[(5-methyl-1,3-oxazol-2-yl)methylamino]pyridine-3-sulfonamide
CID 107143521
N,N-dimethyl-6-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]pyridine-3-sulfonamide
CID 103703160
6-(2-aminopropylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 103341130
6-(cyclopropylmethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113234561
6-[(2-methoxy-2-methylpropyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103704076
6-(2,2-dimethoxyethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 107389803
N-[6-(pyridin-4-ylmethylamino)-3-pyridinyl]ethanesulfonamide
CID 113012955
6-(2-bromoprop-2-enylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113227585

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide?
The IUPAC name of N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide (CID 104999383) is N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide?
The canonical SMILES for N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide is CN(C)S(=O)(=O)c1ccc(NCc2ccncc2)nc1.
What is the InChIKey of N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide?
The InChIKey is ZGWCZWRHYXYOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-17(2)20(18,19)12-3-4-13(16-10-12)15-9-11-5-7-14-8-6-11/h3-8,10H,9H2,1-2H3,(H,15,16).
What are the key properties of N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide?
N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 104999383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).