2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine

C11H23NO4 — CID 104676703

IUPAC2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine
SMILESCCOC1C(N)CC1OCCOCCOC
InChIInChI=1S/C11H23NO4/c1-3-15-11-9(12)8-10(11)16-7-6-14-5-4-13-2/h9-11H,3-8,12H2,1-2H3
InChIKeyPPAGJKJOIUPFFH-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.17
Rot. Bonds9

About 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine

2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine (PubChem CID 104676703) has the molecular formula C11H23NO4 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine.

Molecular Properties

Compound Name2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine
PubChem CID104676703
Molecular FormulaC11H23NO4
Molecular Weight233.31 g/mol
Exact Mass233.16
IUPAC Name2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine
SMILESCCOC1C(N)CC1OCCOCCOC
InChIInChI=1S/C11H23NO4/c1-3-15-11-9(12)8-10(11)16-7-6-14-5-4-13-2/h9-11H,3-8,12H2,1-2H3
InChIKeyPPAGJKJOIUPFFH-UHFFFAOYSA-N
XLogP0.17
TPSA62.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethoxy)-3-[2-(2-methylpropoxy)ethoxy]cyclobutan-1-amine
CID 114032306
1-chloro-2-ethoxy-3-(2-methoxyethoxy)cyclobutane
CID 104675611
3-[2-(2-methoxyethoxy)ethoxy]cyclopentan-1-amine
CID 79466003
1-chloro-2-methoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutane
CID 104674207
1-chloro-2-ethoxy-3-(2-ethoxyethoxy)cyclobutane
CID 104675598
2-(2-methoxyethoxy)-3-(oxolan-3-ylmethoxy)cyclobutan-1-amine
CID 114032285
2-(2-methoxyethoxy)cyclopentan-1-amine
CID 43184183
3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol
CID 104675355
3-cyclopentyloxy-2-ethoxycyclobutan-1-amine
CID 104676119
2-methoxy-3-pentoxycyclobutan-1-amine
CID 104674665
2-(2-methoxyethoxy)-3-(oxan-2-ylmethoxy)cyclobutan-1-amine
CID 114032274
N-ethyl-2-[2-(2-methoxyethoxy)ethoxy]cyclohexan-1-amine
CID 104560797

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine?
The IUPAC name of 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine (CID 104676703) is 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine.
What is the SMILES notation for 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine?
The canonical SMILES for 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine is CCOC1C(N)CC1OCCOCCOC.
What is the InChIKey of 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine?
The InChIKey is PPAGJKJOIUPFFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO4/c1-3-15-11-9(12)8-10(11)16-7-6-14-5-4-13-2/h9-11H,3-8,12H2,1-2H3.
What are the key properties of 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine?
2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine has a molecular weight of 233.31 g/mol, XLogP of 0.17, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-[2-(2-methoxyethoxy)ethoxy]cyclobutan-1-amine is sourced from PubChem (CID 104676703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).