N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide

C11H24N2O3S — CID 69097628

IUPACN-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide
SMILESCC(C)(C)N(CCN1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C11H24N2O3S/c1-11(2,3)13(17(4,14)15)6-5-12-7-9-16-10-8-12/h5-10H2,1-4H3
InChIKeyOTTWCPUZYXHSPQ-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.38
Rot. Bonds4

About N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide

N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide (PubChem CID 69097628) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide
PubChem CID69097628
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide
SMILESCC(C)(C)N(CCN1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C11H24N2O3S/c1-11(2,3)13(17(4,14)15)6-5-12-7-9-16-10-8-12/h5-10H2,1-4H3
InChIKeyOTTWCPUZYXHSPQ-UHFFFAOYSA-N
XLogP0.38
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide?
The IUPAC name of N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide (CID 69097628) is N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide.
What is the SMILES notation for N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide?
The canonical SMILES for N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide is CC(C)(C)N(CCN1CCOCC1)S(C)(=O)=O.
What is the InChIKey of N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide?
The InChIKey is OTTWCPUZYXHSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-11(2,3)13(17(4,14)15)6-5-12-7-9-16-10-8-12/h5-10H2,1-4H3.
What are the key properties of N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide?
N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-(2-morpholin-4-ylethyl)methanesulfonamide is sourced from PubChem (CID 69097628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).