N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine

C14H24N4O3S — CID 88918867

IUPACN-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine
SMILESCCCC(CS(=O)(=O)N1CCN(c2ccccn2)CC1)NO
InChIInChI=1S/C14H24N4O3S/c1-2-5-13(16-19)12-22(20,21)18-10-8-17(9-11-18)14-6-3-4-7-15-14/h3-4,6-7,13,16,19H,2,5,8-12H2,1H3
InChIKeyWEOVJVHEZZIGQJ-UHFFFAOYSA-N
MW328.44 g/mol
LogP0.68
Rot. Bonds7

About N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine

N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine (PubChem CID 88918867) has the molecular formula C14H24N4O3S and a molecular weight of 328.44 g/mol. Its IUPAC name is N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine.

Molecular Properties

Compound NameN-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine
PubChem CID88918867
Molecular FormulaC14H24N4O3S
Molecular Weight328.44 g/mol
Exact Mass328.16
IUPAC NameN-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine
SMILESCCCC(CS(=O)(=O)N1CCN(c2ccccn2)CC1)NO
InChIInChI=1S/C14H24N4O3S/c1-2-5-13(16-19)12-22(20,21)18-10-8-17(9-11-18)14-6-3-4-7-15-14/h3-4,6-7,13,16,19H,2,5,8-12H2,1H3
InChIKeyWEOVJVHEZZIGQJ-UHFFFAOYSA-N
XLogP0.68
TPSA85.77 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 143249477
CID 143249477
N-[4-phenyl-1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylbut-3-yn-2-yl]hydroxylamine
CID 11632442
N-hydroxy-N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylhept-3-yn-2-yl]formamide
CID 11588997
4-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1-trimethylsilylbutan-1-ol
CID 90723023
2-ethyl-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]butanamide
CID 42438782
4-pyridin-2-ylpiperazine-1-sulfonic acid
CID 142758233
N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]propanamide
CID 42438737
1-hexyl-2-methyl-3-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]guanidine
CID 111162119
N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 47151884
N-hydroxy-N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-4-(trimethyl-λ4-sulfanyl)but-3-yn-2-yl]formamide
CID 143249464
4-acetamido-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide
CID 47031694
3-propoxy-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide
CID 55777397

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine?
The IUPAC name of N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine (CID 88918867) is N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine.
What is the SMILES notation for N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine?
The canonical SMILES for N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine is CCCC(CS(=O)(=O)N1CCN(c2ccccn2)CC1)NO.
What is the InChIKey of N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine?
The InChIKey is WEOVJVHEZZIGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3S/c1-2-5-13(16-19)12-22(20,21)18-10-8-17(9-11-18)14-6-3-4-7-15-14/h3-4,6-7,13,16,19H,2,5,8-12H2,1H3.
What are the key properties of N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine?
N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine has a molecular weight of 328.44 g/mol, XLogP of 0.68, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpentan-2-yl]hydroxylamine is sourced from PubChem (CID 88918867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).