N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine

C11H22N2O — CID 143332794

IUPACN,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine
SMILESC/N=C/CC1CC(N(C)C)CC(C)O1
InChIInChI=1S/C11H22N2O/c1-9-7-10(13(3)4)8-11(14-9)5-6-12-2/h6,9-11H,5,7-8H2,1-4H3/b12-6+
InChIKeyZDAFIFUFDBQTSM-WUXMJOGZSA-N
MW198.31 g/mol
LogP1.57
Rot. Bonds3

About N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine

N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine (PubChem CID 143332794) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine.

Molecular Properties

Compound NameN,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine
PubChem CID143332794
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine
SMILESC/N=C/CC1CC(N(C)C)CC(C)O1
InChIInChI=1S/C11H22N2O/c1-9-7-10(13(3)4)8-11(14-9)5-6-12-2/h6,9-11H,5,7-8H2,1-4H3/b12-6+
InChIKeyZDAFIFUFDBQTSM-WUXMJOGZSA-N
XLogP1.57
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine?
The IUPAC name of N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine (CID 143332794) is N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine.
What is the SMILES notation for N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine?
The canonical SMILES for N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine is C/N=C/CC1CC(N(C)C)CC(C)O1.
What is the InChIKey of N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine?
The InChIKey is ZDAFIFUFDBQTSM-WUXMJOGZSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-7-10(13(3)4)8-11(14-9)5-6-12-2/h6,9-11H,5,7-8H2,1-4H3/b12-6+.
What are the key properties of N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine?
N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine has a molecular weight of 198.31 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-6-(2-methyliminoethyl)oxan-4-amine is sourced from PubChem (CID 143332794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).