2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine

C11H24N2O3S — CID 71933162

IUPAC2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
SMILESCC(C)(C)CNCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-11(2,3)10-12-4-9-17(14,15)13-5-7-16-8-6-13/h12H,4-10H2,1-3H3
InChIKeyOMCFZAUPHKAVLR-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.28
Rot. Bonds5

About 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine

2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine (PubChem CID 71933162) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
PubChem CID71933162
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine
SMILESCC(C)(C)CNCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-11(2,3)10-12-4-9-17(14,15)13-5-7-16-8-6-13/h12H,4-10H2,1-3H3
InChIKeyOMCFZAUPHKAVLR-UHFFFAOYSA-N
XLogP0.28
TPSA58.64 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 ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine (CID 71933162) is 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine is CC(C)(C)CNCCS(=O)(=O)N1CCOCC1.
What is the InChIKey of 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
The InChIKey is OMCFZAUPHKAVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-11(2,3)10-12-4-9-17(14,15)13-5-7-16-8-6-13/h12H,4-10H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine?
2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine has a molecular weight of 264.39 g/mol, XLogP of 0.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-morpholin-4-ylsulfonylethyl)propan-1-amine is sourced from PubChem (CID 71933162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).