N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide

C11H22N2O4S — CID 66197636

IUPACN-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide
SMILESCCOC1CC(N)C1NS(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H22N2O4S/c1-2-17-10-7-9(12)11(10)13-18(14,15)8-3-5-16-6-4-8/h8-11,13H,2-7,12H2,1H3
InChIKeyPTXOOCJEJBJZGK-UHFFFAOYSA-N
MW278.37 g/mol
LogP-0.41
Rot. Bonds5

About N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide

N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide (PubChem CID 66197636) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide
PubChem CID66197636
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide
SMILESCCOC1CC(N)C1NS(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H22N2O4S/c1-2-17-10-7-9(12)11(10)13-18(14,15)8-3-5-16-6-4-8/h8-11,13H,2-7,12H2,1H3
InChIKeyPTXOOCJEJBJZGK-UHFFFAOYSA-N
XLogP-0.41
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide (CID 66197636) is N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide is CCOC1CC(N)C1NS(=O)(=O)C1CCOCC1.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide?
The InChIKey is PTXOOCJEJBJZGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-2-17-10-7-9(12)11(10)13-18(14,15)8-3-5-16-6-4-8/h8-11,13H,2-7,12H2,1H3.
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide?
N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide has a molecular weight of 278.37 g/mol, XLogP of -0.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)oxane-4-sulfonamide is sourced from PubChem (CID 66197636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).