6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide

C12H20N4O2S — CID 63209121

IUPAC6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide
SMILESCN(CCN1CCCC1)S(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H20N4O2S/c1-15(8-9-16-6-2-3-7-16)19(17,18)11-4-5-12(13)14-10-11/h4-5,10H,2-3,6-9H2,1H3,(H2,13,14)
InChIKeySRJYNFFHDAADDV-UHFFFAOYSA-N
MW284.38 g/mol
LogP0.38
Rot. Bonds5

About 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide

6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide (PubChem CID 63209121) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide
PubChem CID63209121
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide
SMILESCN(CCN1CCCC1)S(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H20N4O2S/c1-15(8-9-16-6-2-3-7-16)19(17,18)11-4-5-12(13)14-10-11/h4-5,10H,2-3,6-9H2,1H3,(H2,13,14)
InChIKeySRJYNFFHDAADDV-UHFFFAOYSA-N
XLogP0.38
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 63207084
6-amino-N-methyl-N-(3-methylbutyl)pyridine-3-sulfonamide
CID 62152603
4-(2-aminoethyl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 63208977
4-ethoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 110753644
N-methyl-4-propan-2-yloxy-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 110753645
4-cyano-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 63211293
6-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylpyridine-3-sulfonamide
CID 105413746
4-(aminomethyl)-N,3-dimethyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 106919384
5-bromo-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide
CID 63209240
3-(aminomethyl)-4-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 63288906
N-[4-[methyl(2-piperidin-1-ylethyl)sulfamoyl]phenyl]acetamide
CID 110753478
2-amino-6-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 63206519

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide (CID 63209121) is 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide is CN(CCN1CCCC1)S(=O)(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide?
The InChIKey is SRJYNFFHDAADDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-15(8-9-16-6-2-3-7-16)19(17,18)11-4-5-12(13)14-10-11/h4-5,10H,2-3,6-9H2,1H3,(H2,13,14).
What are the key properties of 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide?
6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide has a molecular weight of 284.38 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 63209121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).