N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide

C10H23N3O3S — CID 107200583

IUPACN-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide
SMILESCN(CCCCCO)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H23N3O3S/c1-12(7-3-2-4-10-14)17(15,16)13-8-5-11-6-9-13/h11,14H,2-10H2,1H3
InChIKeyIJENKPMBALLOLX-UHFFFAOYSA-N
MW265.38 g/mol
LogP-0.77
Rot. Bonds7

About N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide

N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide (PubChem CID 107200583) has the molecular formula C10H23N3O3S and a molecular weight of 265.38 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide
PubChem CID107200583
Molecular FormulaC10H23N3O3S
Molecular Weight265.38 g/mol
Exact Mass265.15
IUPAC NameN-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide
SMILESCN(CCCCCO)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H23N3O3S/c1-12(7-3-2-4-10-14)17(15,16)13-8-5-11-6-9-13/h11,14H,2-10H2,1H3
InChIKeyIJENKPMBALLOLX-UHFFFAOYSA-N
XLogP-0.77
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 5-0.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[5-hydroxypentyl(methyl)sulfamoyl]piperidine-4-carboxylic acid
CID 107198638
N-(2-methoxyethyl)-N-methylpiperazine-1-sulfonamide
CID 61252200
N,N-dimethyl-2-[methyl(piperazin-1-ylsulfonyl)amino]acetamide
CID 43375100
1-[5-hydroxypentyl(methyl)sulfamoyl]piperidine-3-carboxylic acid
CID 107198691
N-(cyclopropylmethyl)-N-methylpiperazine-1-sulfonamide;hydrochloride
CID 119961510
N-(5-hydroxypentyl)-N-methyl-2-oxo-2-piperazin-1-ylacetamide
CID 107201769
N-methyl-N-pentan-3-ylpiperazine-1-sulfonamide
CID 43571296
N-(3-hydroxypropyl)-N-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-sulfonamide
CID 79924715
methyl 2-methyl-3-[methyl(piperazin-1-ylsulfonyl)amino]propanoate
CID 61254382
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylpiperazine-1-sulfonamide
CID 105415384
N-(3-hydroxypropyl)-4-(methoxymethyl)-N-methyl-3,6-dihydro-2H-pyridine-1-sulfonamide
CID 114413859
N-methyl-N-(oxan-4-ylmethyl)piperazine-1-sulfonamide
CID 63713108

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide?
The IUPAC name of N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide (CID 107200583) is N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide.
What is the SMILES notation for N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide?
The canonical SMILES for N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide is CN(CCCCCO)S(=O)(=O)N1CCNCC1.
What is the InChIKey of N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide?
The InChIKey is IJENKPMBALLOLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S/c1-12(7-3-2-4-10-14)17(15,16)13-8-5-11-6-9-13/h11,14H,2-10H2,1H3.
What are the key properties of N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide?
N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide has a molecular weight of 265.38 g/mol, XLogP of -0.77, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxypentyl)-N-methylpiperazine-1-sulfonamide is sourced from PubChem (CID 107200583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).