N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine

C11H23NO2 — CID 66352909

IUPACN-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine
SMILESCCCOCCOC1CC(NCC)C1
InChIInChI=1S/C11H23NO2/c1-3-5-13-6-7-14-11-8-10(9-11)12-4-2/h10-12H,3-9H2,1-2H3
InChIKeyIHONCIBVULRLRK-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.57
Rot. Bonds8

About N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine

N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine (PubChem CID 66352909) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine
PubChem CID66352909
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine
SMILESCCCOCCOC1CC(NCC)C1
InChIInChI=1S/C11H23NO2/c1-3-5-13-6-7-14-11-8-10(9-11)12-4-2/h10-12H,3-9H2,1-2H3
InChIKeyIHONCIBVULRLRK-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine?
The IUPAC name of N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine (CID 66352909) is N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine.
What is the SMILES notation for N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine?
The canonical SMILES for N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine is CCCOCCOC1CC(NCC)C1.
What is the InChIKey of N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine?
The InChIKey is IHONCIBVULRLRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-5-13-6-7-14-11-8-10(9-11)12-4-2/h10-12H,3-9H2,1-2H3.
What are the key properties of N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine?
N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.57, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-propoxyethoxy)cyclobutan-1-amine is sourced from PubChem (CID 66352909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).