2-[(3-methylcyclobutyl)methoxy]ethanamine

C8H17NO — CID 119054984

IUPAC2-[(3-methylcyclobutyl)methoxy]ethanamine
SMILESCC1CC(COCCN)C1
InChIInChI=1S/C8H17NO/c1-7-4-8(5-7)6-10-3-2-9/h7-8H,2-6,9H2,1H3
InChIKeyONDKUJFMYGDYCS-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.01
Rot. Bonds4

About 2-[(3-methylcyclobutyl)methoxy]ethanamine

2-[(3-methylcyclobutyl)methoxy]ethanamine (PubChem CID 119054984) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-[(3-methylcyclobutyl)methoxy]ethanamine.

Molecular Properties

Compound Name2-[(3-methylcyclobutyl)methoxy]ethanamine
PubChem CID119054984
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-[(3-methylcyclobutyl)methoxy]ethanamine
SMILESCC1CC(COCCN)C1
InChIInChI=1S/C8H17NO/c1-7-4-8(5-7)6-10-3-2-9/h7-8H,2-6,9H2,1H3
InChIKeyONDKUJFMYGDYCS-UHFFFAOYSA-N
XLogP1.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[(3-methylcyclobutyl)methoxy]ethanamine 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 2-[(3-methylcyclobutyl)methoxy]ethanamine?
The IUPAC name of 2-[(3-methylcyclobutyl)methoxy]ethanamine (CID 119054984) is 2-[(3-methylcyclobutyl)methoxy]ethanamine.
What is the SMILES notation for 2-[(3-methylcyclobutyl)methoxy]ethanamine?
The canonical SMILES for 2-[(3-methylcyclobutyl)methoxy]ethanamine is CC1CC(COCCN)C1.
What is the InChIKey of 2-[(3-methylcyclobutyl)methoxy]ethanamine?
The InChIKey is ONDKUJFMYGDYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7-4-8(5-7)6-10-3-2-9/h7-8H,2-6,9H2,1H3.
What are the key properties of 2-[(3-methylcyclobutyl)methoxy]ethanamine?
2-[(3-methylcyclobutyl)methoxy]ethanamine has a molecular weight of 143.23 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylcyclobutyl)methoxy]ethanamine is sourced from PubChem (CID 119054984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).