N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine

C7H15NO2S — CID 62595114

IUPACN-methyl-1-(1-methylsulfonylcyclobutyl)methanamine
SMILESCNCC1(S(C)(=O)=O)CCC1
InChIInChI=1S/C7H15NO2S/c1-8-6-7(4-3-5-7)11(2,9)10/h8H,3-6H2,1-2H3
InChIKeyUZCQJVKCORNKBG-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.17
Rot. Bonds3

About N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine

N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine (PubChem CID 62595114) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylsulfonylcyclobutyl)methanamine
PubChem CID62595114
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-methyl-1-(1-methylsulfonylcyclobutyl)methanamine
SMILESCNCC1(S(C)(=O)=O)CCC1
InChIInChI=1S/C7H15NO2S/c1-8-6-7(4-3-5-7)11(2,9)10/h8H,3-6H2,1-2H3
InChIKeyUZCQJVKCORNKBG-UHFFFAOYSA-N
XLogP0.17
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine?
The IUPAC name of N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine (CID 62595114) is N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine is CNCC1(S(C)(=O)=O)CCC1.
What is the InChIKey of N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine?
The InChIKey is UZCQJVKCORNKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-8-6-7(4-3-5-7)11(2,9)10/h8H,3-6H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine?
N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine has a molecular weight of 177.27 g/mol, XLogP of 0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylsulfonylcyclobutyl)methanamine is sourced from PubChem (CID 62595114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).