[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine

C11H22N2O — CID 103562615

IUPAC[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
SMILESCC1CC(CN)(N2CCOCC2C)C1
InChIInChI=1S/C11H22N2O/c1-9-5-11(6-9,8-12)13-3-4-14-7-10(13)2/h9-10H,3-8,12H2,1-2H3
InChIKeyBZIICWKRJVPLAT-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.83
Rot. Bonds2

About [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine

[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine (PubChem CID 103562615) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
PubChem CID103562615
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
SMILESCC1CC(CN)(N2CCOCC2C)C1
InChIInChI=1S/C11H22N2O/c1-9-5-11(6-9,8-12)13-3-4-14-7-10(13)2/h9-10H,3-8,12H2,1-2H3
InChIKeyBZIICWKRJVPLAT-UHFFFAOYSA-N
XLogP0.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine?
The IUPAC name of [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine (CID 103562615) is [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine.
What is the SMILES notation for [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine?
The canonical SMILES for [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine is CC1CC(CN)(N2CCOCC2C)C1.
What is the InChIKey of [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine?
The InChIKey is BZIICWKRJVPLAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-5-11(6-9,8-12)13-3-4-14-7-10(13)2/h9-10H,3-8,12H2,1-2H3.
What are the key properties of [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine?
[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine has a molecular weight of 198.31 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine is sourced from PubChem (CID 103562615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).