N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide

C11H24N2O3S — CID 55031389

IUPACN-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide
SMILESCCC(C)(CN)N(C)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-4-11(2,9-12)13(3)17(14,15)10-5-7-16-8-6-10/h10H,4-9,12H2,1-3H3
InChIKeyQBYZIUXWKNPRQU-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.55
Rot. Bonds5

About N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide

N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide (PubChem CID 55031389) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide
PubChem CID55031389
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide
SMILESCCC(C)(CN)N(C)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-4-11(2,9-12)13(3)17(14,15)10-5-7-16-8-6-10/h10H,4-9,12H2,1-3H3
InChIKeyQBYZIUXWKNPRQU-UHFFFAOYSA-N
XLogP0.55
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide?
The IUPAC name of N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide (CID 55031389) is N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide is CCC(C)(CN)N(C)S(=O)(=O)C1CCOCC1.
What is the InChIKey of N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide?
The InChIKey is QBYZIUXWKNPRQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-4-11(2,9-12)13(3)17(14,15)10-5-7-16-8-6-10/h10H,4-9,12H2,1-3H3.
What are the key properties of N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide?
N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylbutan-2-yl)-N-methyloxane-4-sulfonamide is sourced from PubChem (CID 55031389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).