2-(1-ethyl-3-fluorocyclobutyl)ethanamine

C8H16FN — CID 145231518

IUPAC2-(1-ethyl-3-fluorocyclobutyl)ethanamine
SMILESCCC1(CCN)CC(F)C1
InChIInChI=1S/C8H16FN/c1-2-8(3-4-10)5-7(9)6-8/h7H,2-6,10H2,1H3
InChIKeyCQZSVUXXVDTRPJ-UHFFFAOYSA-N
MW145.22 g/mol
LogP1.86
Rot. Bonds3

About 2-(1-ethyl-3-fluorocyclobutyl)ethanamine

2-(1-ethyl-3-fluorocyclobutyl)ethanamine (PubChem CID 145231518) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 2-(1-ethyl-3-fluorocyclobutyl)ethanamine.

Molecular Properties

Compound Name2-(1-ethyl-3-fluorocyclobutyl)ethanamine
PubChem CID145231518
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name2-(1-ethyl-3-fluorocyclobutyl)ethanamine
SMILESCCC1(CCN)CC(F)C1
InChIInChI=1S/C8H16FN/c1-2-8(3-4-10)5-7(9)6-8/h7H,2-6,10H2,1H3
InChIKeyCQZSVUXXVDTRPJ-UHFFFAOYSA-N
XLogP1.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-3-fluorocyclobutyl)ethanamine?
The IUPAC name of 2-(1-ethyl-3-fluorocyclobutyl)ethanamine (CID 145231518) is 2-(1-ethyl-3-fluorocyclobutyl)ethanamine.
What is the SMILES notation for 2-(1-ethyl-3-fluorocyclobutyl)ethanamine?
The canonical SMILES for 2-(1-ethyl-3-fluorocyclobutyl)ethanamine is CCC1(CCN)CC(F)C1.
What is the InChIKey of 2-(1-ethyl-3-fluorocyclobutyl)ethanamine?
The InChIKey is CQZSVUXXVDTRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-2-8(3-4-10)5-7(9)6-8/h7H,2-6,10H2,1H3.
What are the key properties of 2-(1-ethyl-3-fluorocyclobutyl)ethanamine?
2-(1-ethyl-3-fluorocyclobutyl)ethanamine has a molecular weight of 145.22 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-3-fluorocyclobutyl)ethanamine is sourced from PubChem (CID 145231518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).