1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine

C7H15FN2 — CID 147431270

IUPAC1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1(F)CN(C)C1
InChIInChI=1S/C7H15FN2/c1-9(2)4-7(8)5-10(3)6-7/h4-6H2,1-3H3
InChIKeyDUJQGSMEZDNMRJ-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.20
Rot. Bonds2

About 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine

1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine (PubChem CID 147431270) has the molecular formula C7H15FN2 and a molecular weight of 146.21 g/mol. Its IUPAC name is 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine
PubChem CID147431270
Molecular FormulaC7H15FN2
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1(F)CN(C)C1
InChIInChI=1S/C7H15FN2/c1-9(2)4-7(8)5-10(3)6-7/h4-6H2,1-3H3
InChIKeyDUJQGSMEZDNMRJ-UHFFFAOYSA-N
XLogP0.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine (CID 147431270) is 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine is CN(C)CC1(F)CN(C)C1.
What is the InChIKey of 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine?
The InChIKey is DUJQGSMEZDNMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2/c1-9(2)4-7(8)5-10(3)6-7/h4-6H2,1-3H3.
What are the key properties of 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine?
1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine has a molecular weight of 146.21 g/mol, XLogP of 0.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-1-methylazetidin-3-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 147431270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).