N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine

C11H24N2O2 — CID 66215881

IUPACN-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine
SMILESCCCN(CCOCCOC)C1CNC1
InChIInChI=1S/C11H24N2O2/c1-3-4-13(11-9-12-10-11)5-6-15-8-7-14-2/h11-12H,3-10H2,1-2H3
InChIKeyXNCASXBRJQSMIH-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.33
Rot. Bonds9

About N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine

N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine (PubChem CID 66215881) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine
PubChem CID66215881
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine
SMILESCCCN(CCOCCOC)C1CNC1
InChIInChI=1S/C11H24N2O2/c1-3-4-13(11-9-12-10-11)5-6-15-8-7-14-2/h11-12H,3-10H2,1-2H3
InChIKeyXNCASXBRJQSMIH-UHFFFAOYSA-N
XLogP0.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
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

N-[3-(2-methoxyethoxy)propyl]-N-propylazetidin-3-amine
CID 103411100
N,N-bis(2-methoxyethyl)azetidin-3-amine;dihydrochloride
CID 122163592
N-(3-methoxy-2-methylpropyl)-N-propylazetidin-3-amine
CID 116502188
N-(2-butoxyethyl)-N-ethylazetidin-3-amine
CID 66182391
N-(2,2-dimethoxyethyl)-N-propylazetidin-3-amine
CID 81093197
N-[3-(2-methoxyethoxy)propyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 103411042
N-[2-(3-methoxypropoxy)ethyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 103181573
N-(2-bromoethyl)-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopropanamine
CID 104567253
N-(3-methylbutyl)-N-propylazetidin-3-amine
CID 66182647
3-[azetidin-3-yl(propyl)amino]propan-1-ol
CID 66215108
N-(2-methylbutyl)-N-propylazetidin-3-amine
CID 66183920
N-but-3-ynyl-N-propylazetidin-3-amine
CID 66214886

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine (CID 66215881) is N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine is CCCN(CCOCCOC)C1CNC1.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine?
The InChIKey is XNCASXBRJQSMIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-3-4-13(11-9-12-10-11)5-6-15-8-7-14-2/h11-12H,3-10H2,1-2H3.
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine?
N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine has a molecular weight of 216.32 g/mol, XLogP of 0.33, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-N-propylazetidin-3-amine is sourced from PubChem (CID 66215881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).