N,N-dimethylmethanamine;1,3,5-trioxane

C6H15NO3 — CID 66669519

IUPACN,N-dimethylmethanamine;1,3,5-trioxane
SMILESC1OCOCO1.CN(C)C
InChIInChI=1S/C3H9N.C3H6O3/c1-4(2)3;1-4-2-6-3-5-1/h1-3H3;1-3H2
InChIKeyLUKWQHUWRVZTSH-UHFFFAOYSA-N
MW149.19 g/mol
LogP0.10
Rot. Bonds

About N,N-dimethylmethanamine;1,3,5-trioxane

N,N-dimethylmethanamine;1,3,5-trioxane (PubChem CID 66669519) has the molecular formula C6H15NO3 and a molecular weight of 149.19 g/mol. Its IUPAC name is N,N-dimethylmethanamine;1,3,5-trioxane.

Molecular Properties

Compound NameN,N-dimethylmethanamine;1,3,5-trioxane
PubChem CID66669519
Molecular FormulaC6H15NO3
Molecular Weight149.19 g/mol
Exact Mass149.11
IUPAC NameN,N-dimethylmethanamine;1,3,5-trioxane
SMILESC1OCOCO1.CN(C)C
InChIInChI=1S/C3H9N.C3H6O3/c1-4(2)3;1-4-2-6-3-5-1/h1-3H3;1-3H2
InChIKeyLUKWQHUWRVZTSH-UHFFFAOYSA-N
XLogP0.10
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;1,3,5-trioxane?
The IUPAC name of N,N-dimethylmethanamine;1,3,5-trioxane (CID 66669519) is N,N-dimethylmethanamine;1,3,5-trioxane.
What is the SMILES notation for N,N-dimethylmethanamine;1,3,5-trioxane?
The canonical SMILES for N,N-dimethylmethanamine;1,3,5-trioxane is C1OCOCO1.CN(C)C.
What is the InChIKey of N,N-dimethylmethanamine;1,3,5-trioxane?
The InChIKey is LUKWQHUWRVZTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.C3H6O3/c1-4(2)3;1-4-2-6-3-5-1/h1-3H3;1-3H2.
What are the key properties of N,N-dimethylmethanamine;1,3,5-trioxane?
N,N-dimethylmethanamine;1,3,5-trioxane has a molecular weight of 149.19 g/mol, XLogP of 0.10, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;1,3,5-trioxane is sourced from PubChem (CID 66669519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).