1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine

C8H18N2O — CID 89432085

IUPAC1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine
SMILESCNCC1CN(CCOC)C1
InChIInChI=1S/C8H18N2O/c1-9-5-8-6-10(7-8)3-4-11-2/h8-9H,3-7H2,1-2H3
InChIKeyGLJFPOVYCDZFQK-UHFFFAOYSA-N
MW158.25 g/mol
LogP-0.22
Rot. Bonds5

About 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine

1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine (PubChem CID 89432085) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine
PubChem CID89432085
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Name1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine
SMILESCNCC1CN(CCOC)C1
InChIInChI=1S/C8H18N2O/c1-9-5-8-6-10(7-8)3-4-11-2/h8-9H,3-7H2,1-2H3
InChIKeyGLJFPOVYCDZFQK-UHFFFAOYSA-N
XLogP-0.22
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine (CID 89432085) is 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine is CNCC1CN(CCOC)C1.
What is the InChIKey of 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine?
The InChIKey is GLJFPOVYCDZFQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-9-5-8-6-10(7-8)3-4-11-2/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine?
1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine has a molecular weight of 158.25 g/mol, XLogP of -0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)azetidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 89432085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).