[2-(fluoromethyl)cyclobutyl]methanamine

C6H12FN — CID 71756483

IUPAC[2-(fluoromethyl)cyclobutyl]methanamine
SMILESNCC1CCC1CF
InChIInChI=1S/C6H12FN/c7-3-5-1-2-6(5)4-8/h5-6H,1-4,8H2
InChIKeyXSNOQHJFYRWETK-UHFFFAOYSA-N
MW117.17 g/mol
LogP0.94
Rot. Bonds2

About [2-(fluoromethyl)cyclobutyl]methanamine

[2-(fluoromethyl)cyclobutyl]methanamine (PubChem CID 71756483) has the molecular formula C6H12FN and a molecular weight of 117.17 g/mol. Its IUPAC name is [2-(fluoromethyl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[2-(fluoromethyl)cyclobutyl]methanamine
PubChem CID71756483
Molecular FormulaC6H12FN
Molecular Weight117.17 g/mol
Exact Mass117.10
IUPAC Name[2-(fluoromethyl)cyclobutyl]methanamine
SMILESNCC1CCC1CF
InChIInChI=1S/C6H12FN/c7-3-5-1-2-6(5)4-8/h5-6H,1-4,8H2
InChIKeyXSNOQHJFYRWETK-UHFFFAOYSA-N
XLogP0.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.17
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2-(fluoromethyl)cyclobutyl]methanamine?
The IUPAC name of [2-(fluoromethyl)cyclobutyl]methanamine (CID 71756483) is [2-(fluoromethyl)cyclobutyl]methanamine.
What is the SMILES notation for [2-(fluoromethyl)cyclobutyl]methanamine?
The canonical SMILES for [2-(fluoromethyl)cyclobutyl]methanamine is NCC1CCC1CF.
What is the InChIKey of [2-(fluoromethyl)cyclobutyl]methanamine?
The InChIKey is XSNOQHJFYRWETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN/c7-3-5-1-2-6(5)4-8/h5-6H,1-4,8H2.
What are the key properties of [2-(fluoromethyl)cyclobutyl]methanamine?
[2-(fluoromethyl)cyclobutyl]methanamine has a molecular weight of 117.17 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(fluoromethyl)cyclobutyl]methanamine is sourced from PubChem (CID 71756483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).