2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide

C13H22N4O2S — CID 63316665

IUPAC2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide
SMILESCN(CCNS(=O)(=O)c1cccnc1N)C1CCCC1
InChIInChI=1S/C13H22N4O2S/c1-17(11-5-2-3-6-11)10-9-16-20(18,19)12-7-4-8-15-13(12)14/h4,7-8,11,16H,2-3,5-6,9-10H2,1H3,(H2,14,15)
InChIKeySVLCAYYAJPFFTC-UHFFFAOYSA-N
MW298.41 g/mol
LogP0.82
Rot. Bonds6

About 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide

2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide (PubChem CID 63316665) has the molecular formula C13H22N4O2S and a molecular weight of 298.41 g/mol. Its IUPAC name is 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide
PubChem CID63316665
Molecular FormulaC13H22N4O2S
Molecular Weight298.41 g/mol
Exact Mass298.15
IUPAC Name2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide
SMILESCN(CCNS(=O)(=O)c1cccnc1N)C1CCCC1
InChIInChI=1S/C13H22N4O2S/c1-17(11-5-2-3-6-11)10-9-16-20(18,19)12-7-4-8-15-13(12)14/h4,7-8,11,16H,2-3,5-6,9-10H2,1H3,(H2,14,15)
InChIKeySVLCAYYAJPFFTC-UHFFFAOYSA-N
XLogP0.82
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 106594462
2-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]pyridine-3-sulfonamide
CID 62641127
N-[2-[cyclopentyl(methyl)amino]ethyl]-2-hydroxybenzenesulfonamide
CID 81245872
3-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethylpyrazole-4-sulfonamide
CID 63315016
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]pyridine-3-sulfonamide
CID 65427997
2-amino-N-[4-[methyl(propan-2-yl)amino]butyl]pyridine-3-sulfonamide
CID 62156997
2-amino-N-[(2-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 62147960
4-amino-2-chloro-N-[2-[cyclopentyl(methyl)amino]ethyl]benzenesulfonamide
CID 63314929
3-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-1-methylpyrazole-4-sulfonamide
CID 62976625
5-bromo-2-chloro-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 63318055
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-4-sulfonamide
CID 62978743
2-amino-N-(3-ethoxypropyl)pyridine-3-sulfonamide
CID 62144389

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide (CID 63316665) is 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide is CN(CCNS(=O)(=O)c1cccnc1N)C1CCCC1.
What is the InChIKey of 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide?
The InChIKey is SVLCAYYAJPFFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S/c1-17(11-5-2-3-6-11)10-9-16-20(18,19)12-7-4-8-15-13(12)14/h4,7-8,11,16H,2-3,5-6,9-10H2,1H3,(H2,14,15).
What are the key properties of 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide?
2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide has a molecular weight of 298.41 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 63316665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).