N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine

C10H22N2O — CID 102656701

IUPACN-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
SMILESCC(C)N(C)CCOC1(C)CNC1
InChIInChI=1S/C10H22N2O/c1-9(2)12(4)5-6-13-10(3)7-11-8-10/h9,11H,5-8H2,1-4H3
InChIKeyNKEYNUSPUMZQEI-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.71
Rot. Bonds5

About N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine

N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine (PubChem CID 102656701) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
PubChem CID102656701
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
SMILESCC(C)N(C)CCOC1(C)CNC1
InChIInChI=1S/C10H22N2O/c1-9(2)12(4)5-6-13-10(3)7-11-8-10/h9,11H,5-8H2,1-4H3
InChIKeyNKEYNUSPUMZQEI-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The IUPAC name of N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine (CID 102656701) is N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine is CC(C)N(C)CCOC1(C)CNC1.
What is the InChIKey of N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The InChIKey is NKEYNUSPUMZQEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2)12(4)5-6-13-10(3)7-11-8-10/h9,11H,5-8H2,1-4H3.
What are the key properties of N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine has a molecular weight of 186.30 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine is sourced from PubChem (CID 102656701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).