N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine

C10H22N2O2S — CID 81005332

IUPACN-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine
SMILESCNCC1CCC1N(C)CCS(C)(=O)=O
InChIInChI=1S/C10H22N2O2S/c1-11-8-9-4-5-10(9)12(2)6-7-15(3,13)14/h9-11H,4-8H2,1-3H3
InChIKeyGFEOCNQYYSALHL-UHFFFAOYSA-N
MW234.36 g/mol
LogP-0.04
Rot. Bonds6

About N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine

N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine (PubChem CID 81005332) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine
PubChem CID81005332
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine
SMILESCNCC1CCC1N(C)CCS(C)(=O)=O
InChIInChI=1S/C10H22N2O2S/c1-11-8-9-4-5-10(9)12(2)6-7-15(3,13)14/h9-11H,4-8H2,1-3H3
InChIKeyGFEOCNQYYSALHL-UHFFFAOYSA-N
XLogP-0.04
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine?
The IUPAC name of N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine (CID 81005332) is N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine.
What is the SMILES notation for N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine?
The canonical SMILES for N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine is CNCC1CCC1N(C)CCS(C)(=O)=O.
What is the InChIKey of N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine?
The InChIKey is GFEOCNQYYSALHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-11-8-9-4-5-10(9)12(2)6-7-15(3,13)14/h9-11H,4-8H2,1-3H3.
What are the key properties of N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine?
N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine has a molecular weight of 234.36 g/mol, XLogP of -0.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylaminomethyl)-N-(2-methylsulfonylethyl)cyclobutan-1-amine is sourced from PubChem (CID 81005332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).