2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine

C11H24N2O2 — CID 102657009

IUPAC2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
SMILESCCOCCN(C)CCOC1(C)CNC1
InChIInChI=1S/C11H24N2O2/c1-4-14-7-5-13(3)6-8-15-11(2)9-12-10-11/h12H,4-10H2,1-3H3
InChIKeyPOBUWCOLFMGKDF-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.33
Rot. Bonds8

About 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine

2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine (PubChem CID 102657009) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
PubChem CID102657009
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
SMILESCCOCCN(C)CCOC1(C)CNC1
InChIInChI=1S/C11H24N2O2/c1-4-14-7-5-13(3)6-8-15-11(2)9-12-10-11/h12H,4-10H2,1-3H3
InChIKeyPOBUWCOLFMGKDF-UHFFFAOYSA-N
XLogP0.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-Ethoxy-3-methylazetidine
CID 83066072
[2-(Azetidin-3-yloxy)ethyl]diethylamine
CID 63105151
8-Methyl-5-oxa-2,8-diazaspiro[3.5]nonane
CID 82651307
[(3-Methoxyazetidin-3-yl)methyl]dimethylamine
CID 137437565
2,2,2-trifluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102656759
N-ethyl-2,2,2-trifluoro-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102656851
N-[2-(3-methylazetidin-3-yl)oxyethyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 102656855
3,3,3-trifluoro-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-1-amine
CID 102656923
3,3,3-trifluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-1-amine
CID 102656974
2,2-difluoro-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102657014
2,2-difluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102657058
N-[2-(3-methylazetidin-3-yl)oxyethyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 113721346

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine?
The IUPAC name of 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine (CID 102657009) is 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine.
What is the SMILES notation for 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine?
The canonical SMILES for 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine is CCOCCN(C)CCOC1(C)CNC1.
What is the InChIKey of 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine?
The InChIKey is POBUWCOLFMGKDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-14-7-5-13(3)6-8-15-11(2)9-12-10-11/h12H,4-10H2,1-3H3.
What are the key properties of 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine?
2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine has a molecular weight of 216.32 g/mol, XLogP of 0.33, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine is sourced from PubChem (CID 102657009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).