2,6-dimethyl-N-propylpiperazine-1-sulfonamide

C9H21N3O2S — CID 114810806

IUPAC2,6-dimethyl-N-propylpiperazine-1-sulfonamide
SMILESCCCNS(=O)(=O)N1C(C)CNCC1C
InChIInChI=1S/C9H21N3O2S/c1-4-5-11-15(13,14)12-8(2)6-10-7-9(12)3/h8-11H,4-7H2,1-3H3
InChIKeyDKHWPECRDVTGOW-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.09
Rot. Bonds4

About 2,6-dimethyl-N-propylpiperazine-1-sulfonamide

2,6-dimethyl-N-propylpiperazine-1-sulfonamide (PubChem CID 114810806) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is 2,6-dimethyl-N-propylpiperazine-1-sulfonamide.

Molecular Properties

Compound Name2,6-dimethyl-N-propylpiperazine-1-sulfonamide
PubChem CID114810806
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name2,6-dimethyl-N-propylpiperazine-1-sulfonamide
SMILESCCCNS(=O)(=O)N1C(C)CNCC1C
InChIInChI=1S/C9H21N3O2S/c1-4-5-11-15(13,14)12-8(2)6-10-7-9(12)3/h8-11H,4-7H2,1-3H3
InChIKeyDKHWPECRDVTGOW-UHFFFAOYSA-N
XLogP-0.09
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethyl-N-propylpiperazine-1-sulfonamide 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-ethyl-2-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrole-1-sulfonamide
CID 114810364
3,5-dimethyl-N-propylpiperidine-1-sulfonamide
CID 43243297
3-piperazin-1-yl-N-propylazetidine-1-sulfonamide
CID 114811018
2-(aminomethyl)-3-methyl-N-propylpiperidine-1-sulfonamide
CID 114810844
2-(hydroxymethyl)-5-methyl-N-propylmorpholine-4-sulfonamide
CID 114809725
N-butyl-2,6-dimethylpiperazine-1-carboxamide
CID 63911594
N,2,4-trimethylazetidine-1-sulfonamide
CID 126990130
2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide
CID 82713907
2-propan-2-yl-3-(propylsulfamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 114806191
(2S,6R)-2,6-dimethyl-1-propylpiperazine;hydrochloride
CID 130710519
1-(4-ethoxyphenyl)sulfonyl-2,6-dimethylpiperazine
CID 63909437
1-(5-ethylthiophen-2-yl)sulfonyl-2,6-dimethylpiperazine
CID 63910226

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-propylpiperazine-1-sulfonamide?
The IUPAC name of 2,6-dimethyl-N-propylpiperazine-1-sulfonamide (CID 114810806) is 2,6-dimethyl-N-propylpiperazine-1-sulfonamide.
What is the SMILES notation for 2,6-dimethyl-N-propylpiperazine-1-sulfonamide?
The canonical SMILES for 2,6-dimethyl-N-propylpiperazine-1-sulfonamide is CCCNS(=O)(=O)N1C(C)CNCC1C.
What is the InChIKey of 2,6-dimethyl-N-propylpiperazine-1-sulfonamide?
The InChIKey is DKHWPECRDVTGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-4-5-11-15(13,14)12-8(2)6-10-7-9(12)3/h8-11H,4-7H2,1-3H3.
What are the key properties of 2,6-dimethyl-N-propylpiperazine-1-sulfonamide?
2,6-dimethyl-N-propylpiperazine-1-sulfonamide has a molecular weight of 235.35 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-propylpiperazine-1-sulfonamide is sourced from PubChem (CID 114810806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).