N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide

C11H24N2O3S — CID 71860312

IUPACN-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide
SMILESCN(C)CCN(C)S(=O)(=O)CC1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-12(2)6-7-13(3)17(14,15)10-11-4-8-16-9-5-11/h11H,4-10H2,1-3H3
InChIKeyKZKHEOVQOAFZGI-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.24
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide

N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide (PubChem CID 71860312) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide
PubChem CID71860312
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide
SMILESCN(C)CCN(C)S(=O)(=O)CC1CCOCC1
InChIInChI=1S/C11H24N2O3S/c1-12(2)6-7-13(3)17(14,15)10-11-4-8-16-9-5-11/h11H,4-10H2,1-3H3
InChIKeyKZKHEOVQOAFZGI-UHFFFAOYSA-N
XLogP0.24
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide (CID 71860312) is N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide is CN(C)CCN(C)S(=O)(=O)CC1CCOCC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide?
The InChIKey is KZKHEOVQOAFZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-12(2)6-7-13(3)17(14,15)10-11-4-8-16-9-5-11/h11H,4-10H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide?
N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.24, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-methyl-1-(oxan-4-yl)methanesulfonamide is sourced from PubChem (CID 71860312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).