N-(5-amino-4-methylpentyl)oxane-4-sulfonamide

C11H24N2O3S — CID 106154225

IUPACN-(5-amino-4-methylpentyl)oxane-4-sulfonamide
SMILESCC(CN)CCCNS(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-10(9-12)3-2-6-13-17(14,15)11-4-7-16-8-5-11/h10-11,13H,2-9,12H2,1H3
InChIKeyUEGFAODBMSDSQW-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.46
Rot. Bonds7

About N-(5-amino-4-methylpentyl)oxane-4-sulfonamide

N-(5-amino-4-methylpentyl)oxane-4-sulfonamide (PubChem CID 106154225) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-(5-amino-4-methylpentyl)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(5-amino-4-methylpentyl)oxane-4-sulfonamide
PubChem CID106154225
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-(5-amino-4-methylpentyl)oxane-4-sulfonamide
SMILESCC(CN)CCCNS(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-10(9-12)3-2-6-13-17(14,15)11-4-7-16-8-5-11/h10-11,13H,2-9,12H2,1H3
InChIKeyUEGFAODBMSDSQW-UHFFFAOYSA-N
XLogP0.46
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(5-amino-4-methylpentyl)oxane-4-sulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-4-methylpentyl)oxane-4-sulfonamide?
The IUPAC name of N-(5-amino-4-methylpentyl)oxane-4-sulfonamide (CID 106154225) is N-(5-amino-4-methylpentyl)oxane-4-sulfonamide.
What is the SMILES notation for N-(5-amino-4-methylpentyl)oxane-4-sulfonamide?
The canonical SMILES for N-(5-amino-4-methylpentyl)oxane-4-sulfonamide is CC(CN)CCCNS(=O)(=O)C1CCOCC1.
What is the InChIKey of N-(5-amino-4-methylpentyl)oxane-4-sulfonamide?
The InChIKey is UEGFAODBMSDSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-10(9-12)3-2-6-13-17(14,15)11-4-7-16-8-5-11/h10-11,13H,2-9,12H2,1H3.
What are the key properties of N-(5-amino-4-methylpentyl)oxane-4-sulfonamide?
N-(5-amino-4-methylpentyl)oxane-4-sulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-4-methylpentyl)oxane-4-sulfonamide is sourced from PubChem (CID 106154225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).