5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one

C12H19N3O3S — CID 43629026

IUPAC5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one
SMILESCCCN1CCN(S(=O)(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C12H19N3O3S/c1-2-5-14-6-8-15(9-7-14)19(17,18)11-3-4-12(16)13-10-11/h3-4,10H,2,5-9H2,1H3,(H,13,16)
InChIKeyHADSYALPFUHOJE-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.09
Rot. Bonds4

About 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one

5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one (PubChem CID 43629026) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one
PubChem CID43629026
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one
SMILESCCCN1CCN(S(=O)(=O)c2ccc(=O)[nH]c2)CC1
InChIInChI=1S/C12H19N3O3S/c1-2-5-14-6-8-15(9-7-14)19(17,18)11-3-4-12(16)13-10-11/h3-4,10H,2,5-9H2,1H3,(H,13,16)
InChIKeyHADSYALPFUHOJE-UHFFFAOYSA-N
XLogP0.09
TPSA73.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one with MolForge

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

Launch Full Analysis

Related Compounds

N,N-diethyl-6-oxo-1,6-dihydropyridine-3-sulfonamide
CID 829843
5-[(4-Methyl-1-piperazinyl)sulfonyl]-2-pyridinol
CID 829832
6-hydroxy-N,N-diisopropyl-3-pyridinesulfonamide
CID 829836
5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]sulfonyl-1H-pyridin-2-one
CID 43629454
2-(2-oxo-5-(piperidin-1-ylsulfonyl)pyridin-1(2H)-yl)-N-propylacetamide
CID 49667032
5-(Piperidine-1-sulfonyl)-1,2-dihydropyridin-2-one
CID 5268015
6-oxo-N,N-bis(prop-2-enyl)-1H-pyridine-3-sulfonamide
CID 43629018
6-Oxo-N-propyl-1,6-dihydropyridine-3-sulfonamide
CID 43629031
(E)-N-methyl-4-(4-methylsulfonylpiperazin-1-yl)but-2-enamide
CID 90066055
1-[2-(Dimethylamino)ethyl]-1,6-dihydro-6-oxo-3-pyridinesulfonamide
CID 137403789
5-(4-ethylpiperazin-1-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide
CID 141012530
2-[5-(diethylsulfamoyl)-2-oxo-1-pyridinyl]-N-(2-methylpropyl)acetamide
CID 7252295

Frequently Asked Questions

What is the IUPAC name of 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one?
The IUPAC name of 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one (CID 43629026) is 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one.
What is the SMILES notation for 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one?
The canonical SMILES for 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one is CCCN1CCN(S(=O)(=O)c2ccc(=O)[nH]c2)CC1.
What is the InChIKey of 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one?
The InChIKey is HADSYALPFUHOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-2-5-14-6-8-15(9-7-14)19(17,18)11-3-4-12(16)13-10-11/h3-4,10H,2,5-9H2,1H3,(H,13,16).
What are the key properties of 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one?
5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one has a molecular weight of 285.37 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-propylpiperazin-1-yl)sulfonyl-1H-pyridin-2-one is sourced from PubChem (CID 43629026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).