N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine

C11H22N2O — CID 116679681

IUPACN-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine
SMILESCOCCN(CCC1CNC1)C1CC1
InChIInChI=1S/C11H22N2O/c1-14-7-6-13(11-2-3-11)5-4-10-8-12-9-10/h10-12H,2-9H2,1H3
InChIKeyHREPTMGWWVCELL-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.71
Rot. Bonds7

About N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine

N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine (PubChem CID 116679681) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine.

Molecular Properties

Compound NameN-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine
PubChem CID116679681
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine
SMILESCOCCN(CCC1CNC1)C1CC1
InChIInChI=1S/C11H22N2O/c1-14-7-6-13(11-2-3-11)5-4-10-8-12-9-10/h10-12H,2-9H2,1H3
InChIKeyHREPTMGWWVCELL-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(azetidin-3-yl)-N-(2-methoxyethyl)-N-methylethanamine
CID 116679616
N,N-bis(2-methoxyethyl)azetidin-3-amine;dihydrochloride
CID 122163592
N,N-bis(2-methoxyethyl)piperidin-4-amine
CID 61418821
N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine
CID 66422757
N-[2-(azetidin-3-yl)ethyl]-N-(2-methylpropyl)cyclopentanamine
CID 116680263
N-[2-(3-methoxypropoxy)ethyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 103181621
N'-cyclopropyl-N-ethyl-N'-(2-methoxyethyl)ethane-1,2-diamine
CID 61451815
N-(2,2-dimethoxyethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 66222965
2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 62371781
N-(2-azidoethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 61452045
N-(2-methoxyethyl)-N-methylazetidin-3-amine;dihydrochloride
CID 137347103
N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine
CID 66215881

Frequently Asked Questions

What is the IUPAC name of N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine?
The IUPAC name of N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine (CID 116679681) is N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine.
What is the SMILES notation for N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine?
The canonical SMILES for N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine is COCCN(CCC1CNC1)C1CC1.
What is the InChIKey of N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine?
The InChIKey is HREPTMGWWVCELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-14-7-6-13(11-2-3-11)5-4-10-8-12-9-10/h10-12H,2-9H2,1H3.
What are the key properties of N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine?
N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine has a molecular weight of 198.31 g/mol, XLogP of 0.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine is sourced from PubChem (CID 116679681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).