[3-(fluoromethyl)azetidin-3-yl]methanamine

C5H11FN2 — CID 105427144

IUPAC[3-(fluoromethyl)azetidin-3-yl]methanamine
SMILESNCC1(CF)CNC1
InChIInChI=1S/C5H11FN2/c6-1-5(2-7)3-8-4-5/h8H,1-4,7H2
InChIKeyUZLOBDAAJPWBJK-UHFFFAOYSA-N
MW118.16 g/mol
LogP-0.50
Rot. Bonds2

About [3-(fluoromethyl)azetidin-3-yl]methanamine

[3-(fluoromethyl)azetidin-3-yl]methanamine (PubChem CID 105427144) has the molecular formula C5H11FN2 and a molecular weight of 118.16 g/mol. Its IUPAC name is [3-(fluoromethyl)azetidin-3-yl]methanamine.

Molecular Properties

Compound Name[3-(fluoromethyl)azetidin-3-yl]methanamine
PubChem CID105427144
Molecular FormulaC5H11FN2
Molecular Weight118.16 g/mol
Exact Mass118.09
IUPAC Name[3-(fluoromethyl)azetidin-3-yl]methanamine
SMILESNCC1(CF)CNC1
InChIInChI=1S/C5H11FN2/c6-1-5(2-7)3-8-4-5/h8H,1-4,7H2
InChIKeyUZLOBDAAJPWBJK-UHFFFAOYSA-N
XLogP-0.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.16
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(fluoromethyl)azetidin-3-yl]methanamine?
The IUPAC name of [3-(fluoromethyl)azetidin-3-yl]methanamine (CID 105427144) is [3-(fluoromethyl)azetidin-3-yl]methanamine.
What is the SMILES notation for [3-(fluoromethyl)azetidin-3-yl]methanamine?
The canonical SMILES for [3-(fluoromethyl)azetidin-3-yl]methanamine is NCC1(CF)CNC1.
What is the InChIKey of [3-(fluoromethyl)azetidin-3-yl]methanamine?
The InChIKey is UZLOBDAAJPWBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2/c6-1-5(2-7)3-8-4-5/h8H,1-4,7H2.
What are the key properties of [3-(fluoromethyl)azetidin-3-yl]methanamine?
[3-(fluoromethyl)azetidin-3-yl]methanamine has a molecular weight of 118.16 g/mol, XLogP of -0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(fluoromethyl)azetidin-3-yl]methanamine is sourced from PubChem (CID 105427144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).