1-cyclobutyl-N-ethylethanamine

C8H17N — CID 64986458

IUPAC1-cyclobutyl-N-ethylethanamine
SMILESCCNC(C)C1CCC1
InChIInChI=1S/C8H17N/c1-3-9-7(2)8-5-4-6-8/h7-9H,3-6H2,1-2H3
InChIKeyVKWKATXJOIIVAN-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.78
Rot. Bonds3

About 1-cyclobutyl-N-ethylethanamine

1-cyclobutyl-N-ethylethanamine (PubChem CID 64986458) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is 1-cyclobutyl-N-ethylethanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-ethylethanamine
PubChem CID64986458
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name1-cyclobutyl-N-ethylethanamine
SMILESCCNC(C)C1CCC1
InChIInChI=1S/C8H17N/c1-3-9-7(2)8-5-4-6-8/h7-9H,3-6H2,1-2H3
InChIKeyVKWKATXJOIIVAN-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclobutyl-N-ethylethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-ethylethanamine?
The IUPAC name of 1-cyclobutyl-N-ethylethanamine (CID 64986458) is 1-cyclobutyl-N-ethylethanamine.
What is the SMILES notation for 1-cyclobutyl-N-ethylethanamine?
The canonical SMILES for 1-cyclobutyl-N-ethylethanamine is CCNC(C)C1CCC1.
What is the InChIKey of 1-cyclobutyl-N-ethylethanamine?
The InChIKey is VKWKATXJOIIVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-3-9-7(2)8-5-4-6-8/h7-9H,3-6H2,1-2H3.
What are the key properties of 1-cyclobutyl-N-ethylethanamine?
1-cyclobutyl-N-ethylethanamine has a molecular weight of 127.23 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-ethylethanamine is sourced from PubChem (CID 64986458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).