2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine

C13H22N4O2S — CID 71847500

IUPAC2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine
SMILESCN(C1CCCC1)S(=O)(=O)NCCNc1ccccn1
InChIInChI=1S/C13H22N4O2S/c1-17(12-6-2-3-7-12)20(18,19)16-11-10-15-13-8-4-5-9-14-13/h4-5,8-9,12,16H,2-3,6-7,10-11H2,1H3,(H,14,15)
InChIKeyITDHEYXNHVIXKE-UHFFFAOYSA-N
MW298.41 g/mol
LogP1.20
Rot. Bonds7

About 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine

2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine (PubChem CID 71847500) has the molecular formula C13H22N4O2S and a molecular weight of 298.41 g/mol. Its IUPAC name is 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine.

Molecular Properties

Compound Name2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine
PubChem CID71847500
Molecular FormulaC13H22N4O2S
Molecular Weight298.41 g/mol
Exact Mass298.15
IUPAC Name2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine
SMILESCN(C1CCCC1)S(=O)(=O)NCCNc1ccccn1
InChIInChI=1S/C13H22N4O2S/c1-17(12-6-2-3-7-12)20(18,19)16-11-10-15-13-8-4-5-9-14-13/h4-5,8-9,12,16H,2-3,6-7,10-11H2,1H3,(H,14,15)
InChIKeyITDHEYXNHVIXKE-UHFFFAOYSA-N
XLogP1.20
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine?
The IUPAC name of 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine (CID 71847500) is 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine.
What is the SMILES notation for 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine?
The canonical SMILES for 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine is CN(C1CCCC1)S(=O)(=O)NCCNc1ccccn1.
What is the InChIKey of 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine?
The InChIKey is ITDHEYXNHVIXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S/c1-17(12-6-2-3-7-12)20(18,19)16-11-10-15-13-8-4-5-9-14-13/h4-5,8-9,12,16H,2-3,6-7,10-11H2,1H3,(H,14,15).
What are the key properties of 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine?
2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine has a molecular weight of 298.41 g/mol, XLogP of 1.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[cyclopentyl(methyl)sulfamoyl]amino]ethylamino]pyridine is sourced from PubChem (CID 71847500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).