2-(3-methoxycyclobutyl)ethanamine

C7H15NO — CID 106824044

IUPAC2-(3-methoxycyclobutyl)ethanamine
SMILESCOC1CC(CCN)C1
InChIInChI=1S/C7H15NO/c1-9-7-4-6(5-7)2-3-8/h6-7H,2-5,8H2,1H3
InChIKeyUANJXRLIZBBKTD-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.76
Rot. Bonds3

About 2-(3-methoxycyclobutyl)ethanamine

2-(3-methoxycyclobutyl)ethanamine (PubChem CID 106824044) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-(3-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxycyclobutyl)ethanamine
PubChem CID106824044
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-(3-methoxycyclobutyl)ethanamine
SMILESCOC1CC(CCN)C1
InChIInChI=1S/C7H15NO/c1-9-7-4-6(5-7)2-3-8/h6-7H,2-5,8H2,1H3
InChIKeyUANJXRLIZBBKTD-UHFFFAOYSA-N
XLogP0.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxycyclobutyl)ethanamine?
The IUPAC name of 2-(3-methoxycyclobutyl)ethanamine (CID 106824044) is 2-(3-methoxycyclobutyl)ethanamine.
What is the SMILES notation for 2-(3-methoxycyclobutyl)ethanamine?
The canonical SMILES for 2-(3-methoxycyclobutyl)ethanamine is COC1CC(CCN)C1.
What is the InChIKey of 2-(3-methoxycyclobutyl)ethanamine?
The InChIKey is UANJXRLIZBBKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-9-7-4-6(5-7)2-3-8/h6-7H,2-5,8H2,1H3.
What are the key properties of 2-(3-methoxycyclobutyl)ethanamine?
2-(3-methoxycyclobutyl)ethanamine has a molecular weight of 129.20 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 106824044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).