2-(1-but-3-enoxycyclobutyl)ethanamine

C10H19NO — CID 103272995

IUPAC2-(1-but-3-enoxycyclobutyl)ethanamine
SMILESC=CCCOC1(CCN)CCC1
InChIInChI=1S/C10H19NO/c1-2-3-9-12-10(7-8-11)5-4-6-10/h2H,1,3-9,11H2
InChIKeyCEOQTBJDXQNZJS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.85
Rot. Bonds6

About 2-(1-but-3-enoxycyclobutyl)ethanamine

2-(1-but-3-enoxycyclobutyl)ethanamine (PubChem CID 103272995) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(1-but-3-enoxycyclobutyl)ethanamine.

Molecular Properties

Compound Name2-(1-but-3-enoxycyclobutyl)ethanamine
PubChem CID103272995
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-(1-but-3-enoxycyclobutyl)ethanamine
SMILESC=CCCOC1(CCN)CCC1
InChIInChI=1S/C10H19NO/c1-2-3-9-12-10(7-8-11)5-4-6-10/h2H,1,3-9,11H2
InChIKeyCEOQTBJDXQNZJS-UHFFFAOYSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(3-But-3-enoxy-3-methylbutoxy)-3-methylpentan-1-amine
CID 89228231
(3-But-3-enoxycyclobutyl)methanamine
CID 65982824
2-(1-Prop-2-enoxycyclobutyl)ethanamine
CID 103272987
N-[2-(1-but-3-enoxycyclobutyl)ethyl]-2-methylpropan-1-amine
CID 103272996
N-[2-(1-but-3-enoxycyclobutyl)ethyl]propan-1-amine
CID 103272997
2-(1-but-3-enoxycyclobutyl)-N-ethylethanamine
CID 103272998
N-[2-(1-but-3-enoxycyclobutyl)ethyl]-2-methylpropan-2-amine
CID 103272999
N-[2-(1-but-3-enoxycyclobutyl)ethyl]propan-2-amine
CID 103273001
2-(1-but-3-enoxycyclobutyl)-N-methylethanamine
CID 103273002
2-(1-Pent-4-enoxycyclobutyl)ethanamine
CID 103274236
N-[2-(1-pent-4-enoxycyclobutyl)ethyl]propan-1-amine
CID 103274238
N-ethyl-2-(1-pent-4-enoxycyclobutyl)ethanamine
CID 103274239

Frequently Asked Questions

What is the IUPAC name of 2-(1-but-3-enoxycyclobutyl)ethanamine?
The IUPAC name of 2-(1-but-3-enoxycyclobutyl)ethanamine (CID 103272995) is 2-(1-but-3-enoxycyclobutyl)ethanamine.
What is the SMILES notation for 2-(1-but-3-enoxycyclobutyl)ethanamine?
The canonical SMILES for 2-(1-but-3-enoxycyclobutyl)ethanamine is C=CCCOC1(CCN)CCC1.
What is the InChIKey of 2-(1-but-3-enoxycyclobutyl)ethanamine?
The InChIKey is CEOQTBJDXQNZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-3-9-12-10(7-8-11)5-4-6-10/h2H,1,3-9,11H2.
What are the key properties of 2-(1-but-3-enoxycyclobutyl)ethanamine?
2-(1-but-3-enoxycyclobutyl)ethanamine has a molecular weight of 169.27 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-but-3-enoxycyclobutyl)ethanamine is sourced from PubChem (CID 103272995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).