2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine

C14H23NO — CID 115863601

IUPAC2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
SMILESCCNC(CC1CCC1)c1ccc(CC)o1
InChIInChI=1S/C14H23NO/c1-3-12-8-9-14(16-12)13(15-4-2)10-11-6-5-7-11/h8-9,11,13,15H,3-7,10H2,1-2H3
InChIKeyGUVFSEZLEMVIAJ-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.68
Rot. Bonds6

About 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine

2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine (PubChem CID 115863601) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
PubChem CID115863601
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
SMILESCCNC(CC1CCC1)c1ccc(CC)o1
InChIInChI=1S/C14H23NO/c1-3-12-8-9-14(16-12)13(15-4-2)10-11-6-5-7-11/h8-9,11,13,15H,3-7,10H2,1-2H3
InChIKeyGUVFSEZLEMVIAJ-UHFFFAOYSA-N
XLogP3.68
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine?
The IUPAC name of 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine (CID 115863601) is 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine.
What is the SMILES notation for 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine?
The canonical SMILES for 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine is CCNC(CC1CCC1)c1ccc(CC)o1.
What is the InChIKey of 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine?
The InChIKey is GUVFSEZLEMVIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-3-12-8-9-14(16-12)13(15-4-2)10-11-6-5-7-11/h8-9,11,13,15H,3-7,10H2,1-2H3.
What are the key properties of 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine?
2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine has a molecular weight of 221.34 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine is sourced from PubChem (CID 115863601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).