N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide

C13H23N3O2S — CID 55044262

IUPACN-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)NC(C)CCC
InChIInChI=1S/C13H23N3O2S/c1-4-7-11(3)16-19(17,18)12-8-6-10-15-13(12)14-9-5-2/h6,8,10-11,16H,4-5,7,9H2,1-3H3,(H,14,15)
InChIKeyJKQPDCVJHDJYHG-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.37
Rot. Bonds8

About N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide

N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide (PubChem CID 55044262) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide
PubChem CID55044262
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC NameN-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)NC(C)CCC
InChIInChI=1S/C13H23N3O2S/c1-4-7-11(3)16-19(17,18)12-8-6-10-15-13(12)14-9-5-2/h6,8,10-11,16H,4-5,7,9H2,1-3H3,(H,14,15)
InChIKeyJKQPDCVJHDJYHG-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methylhexan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 63925751
2-(ethylamino)-N-octan-2-ylpyridine-3-sulfonamide
CID 63473663
N-(4-methylpentyl)-2-(propylamino)pyridine-3-sulfonamide
CID 63003516
N-[1-(furan-2-yl)ethyl]-2-(propylamino)pyridine-3-sulfonamide
CID 62145541
N-ethyl-2-[[2-(propylamino)-3-pyridinyl]sulfonylamino]propanamide
CID 62152812
N-(2,2-difluoroethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 113304047
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 103094788
2-(methylamino)-N-(4-methylsulfanylbutan-2-yl)pyridine-3-sulfonamide
CID 113478168
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62145695
N-methyl-N-(4-methylpentan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 62152933
2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]-N-propylpropanamide
CID 62151211
N-(2-iodophenyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62144258

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide (CID 55044262) is N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide is CCCNc1ncccc1S(=O)(=O)NC(C)CCC.
What is the InChIKey of N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide?
The InChIKey is JKQPDCVJHDJYHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-4-7-11(3)16-19(17,18)12-8-6-10-15-13(12)14-9-5-2/h6,8,10-11,16H,4-5,7,9H2,1-3H3,(H,14,15).
What are the key properties of N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide?
N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-2-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 55044262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).