1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine

C6H13FN2 — CID 89401815

IUPAC1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1(F)CNC1
InChIInChI=1S/C6H13FN2/c1-9(2)5-6(7)3-8-4-6/h8H,3-5H2,1-2H3
InChIKeySCFXHXRIAONXON-UHFFFAOYSA-N
MW132.18 g/mol
LogP-0.14
Rot. Bonds2

About 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine

1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine (PubChem CID 89401815) has the molecular formula C6H13FN2 and a molecular weight of 132.18 g/mol. Its IUPAC name is 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine
PubChem CID89401815
Molecular FormulaC6H13FN2
Molecular Weight132.18 g/mol
Exact Mass132.11
IUPAC Name1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1(F)CNC1
InChIInChI=1S/C6H13FN2/c1-9(2)5-6(7)3-8-4-6/h8H,3-5H2,1-2H3
InChIKeySCFXHXRIAONXON-UHFFFAOYSA-N
XLogP-0.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine (CID 89401815) is 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine is CN(C)CC1(F)CNC1.
What is the InChIKey of 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine?
The InChIKey is SCFXHXRIAONXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FN2/c1-9(2)5-6(7)3-8-4-6/h8H,3-5H2,1-2H3.
What are the key properties of 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine?
1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine has a molecular weight of 132.18 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoroazetidin-3-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 89401815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).