N-(3-aminocyclobutyl)oxane-4-sulfonamide

C9H18N2O3S — CID 62050137

IUPACN-(3-aminocyclobutyl)oxane-4-sulfonamide
SMILESNC1CC(NS(=O)(=O)C2CCOCC2)C1
InChIInChI=1S/C9H18N2O3S/c10-7-5-8(6-7)11-15(12,13)9-1-3-14-4-2-9/h7-9,11H,1-6,10H2
InChIKeyHYXBNUMFKOLLJK-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.43
Rot. Bonds3

About N-(3-aminocyclobutyl)oxane-4-sulfonamide

N-(3-aminocyclobutyl)oxane-4-sulfonamide (PubChem CID 62050137) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)oxane-4-sulfonamide
PubChem CID62050137
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC NameN-(3-aminocyclobutyl)oxane-4-sulfonamide
SMILESNC1CC(NS(=O)(=O)C2CCOCC2)C1
InChIInChI=1S/C9H18N2O3S/c10-7-5-8(6-7)11-15(12,13)9-1-3-14-4-2-9/h7-9,11H,1-6,10H2
InChIKeyHYXBNUMFKOLLJK-UHFFFAOYSA-N
XLogP-0.43
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyloxane-4-sulfonamide
CID 56824320
N-(oxan-4-yl)propane-2-sulfonamide
CID 61355877
N-(oxan-4-yl)propane-1-sulfonamide
CID 61384178
N-isopropyltetrahydro-2H-pyran-4-sulfonamide
CID 64295375
N-(oxan-4-yl)butane-1-sulfonamide
CID 110726870
2-amino-N-(oxan-4-yl)ethanesulfonamide
CID 43610045
3-amino-N-(oxan-4-yl)propane-1-sulfonamide
CID 60910508
4-amino-N-(oxan-4-yl)butane-1-sulfonamide
CID 61456909
4-amino-N-methyl-N-(oxan-4-yl)butane-1-sulfonamide
CID 61456910
N-(3-aminopropyl)oxane-4-sulfonamide
CID 62047529
N-(4-aminobutyl)oxane-4-sulfonamide
CID 62047530
N-(1-aminopropan-2-yl)oxane-4-sulfonamide
CID 62047878

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)oxane-4-sulfonamide?
The IUPAC name of N-(3-aminocyclobutyl)oxane-4-sulfonamide (CID 62050137) is N-(3-aminocyclobutyl)oxane-4-sulfonamide.
What is the SMILES notation for N-(3-aminocyclobutyl)oxane-4-sulfonamide?
The canonical SMILES for N-(3-aminocyclobutyl)oxane-4-sulfonamide is NC1CC(NS(=O)(=O)C2CCOCC2)C1.
What is the InChIKey of N-(3-aminocyclobutyl)oxane-4-sulfonamide?
The InChIKey is HYXBNUMFKOLLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c10-7-5-8(6-7)11-15(12,13)9-1-3-14-4-2-9/h7-9,11H,1-6,10H2.
What are the key properties of N-(3-aminocyclobutyl)oxane-4-sulfonamide?
N-(3-aminocyclobutyl)oxane-4-sulfonamide has a molecular weight of 234.32 g/mol, XLogP of -0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)oxane-4-sulfonamide is sourced from PubChem (CID 62050137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).