N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine

C11H14F2N2 — CID 66188228

IUPACN-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine
SMILESCN(Cc1ccc(F)cc1F)C1CNC1
InChIInChI=1S/C11H14F2N2/c1-15(10-5-14-6-10)7-8-2-3-9(12)4-11(8)13/h2-4,10,14H,5-7H2,1H3
InChIKeyMOXOPCNPYREYAP-UHFFFAOYSA-N
MW212.24 g/mol
LogP1.37
Rot. Bonds3

About N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine

N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine (PubChem CID 66188228) has the molecular formula C11H14F2N2 and a molecular weight of 212.24 g/mol. Its IUPAC name is N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine.

Molecular Properties

Compound NameN-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine
PubChem CID66188228
Molecular FormulaC11H14F2N2
Molecular Weight212.24 g/mol
Exact Mass212.11
IUPAC NameN-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine
SMILESCN(Cc1ccc(F)cc1F)C1CNC1
InChIInChI=1S/C11H14F2N2/c1-15(10-5-14-6-10)7-8-2-3-9(12)4-11(8)13/h2-4,10,14H,5-7H2,1H3
InChIKeyMOXOPCNPYREYAP-UHFFFAOYSA-N
XLogP1.37
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-difluorophenyl)methyl]-N-methylpyrrolidin-3-amine
CID 63297959
N-[(5-fluoro-2-methylphenyl)methyl]-N-methylazetidin-3-amine
CID 105372573
N-[(2-chloro-5-fluorophenyl)methyl]-N-methylazetidin-3-amine
CID 102616994
N-[(2,4-difluorophenyl)methyl]-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921538
N-[(2,5-difluorophenyl)methyl]-N-propylazetidin-3-amine
CID 66182006
[(2,4-difluorophenyl)methyl-methylamino]methanol
CID 115229150
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylpiperidin-3-amine
CID 63643030
N-[(2,4-difluorophenyl)methyl]-N-methylformamide
CID 64990427
2-bromo-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]acetamide
CID 63679516
2-[(2,4-difluorophenyl)methyl]-6-methylmorpholine
CID 82287919
3-fluoro-4-[[methyl(piperidin-3-yl)amino]methyl]benzamide
CID 63642494
N-[(2-bromo-4-fluorophenyl)methyl]-N-propylazetidin-3-amine
CID 66215692

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine?
The IUPAC name of N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine (CID 66188228) is N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine.
What is the SMILES notation for N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine?
The canonical SMILES for N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine is CN(Cc1ccc(F)cc1F)C1CNC1.
What is the InChIKey of N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine?
The InChIKey is MOXOPCNPYREYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2/c1-15(10-5-14-6-10)7-8-2-3-9(12)4-11(8)13/h2-4,10,14H,5-7H2,1H3.
What are the key properties of N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine?
N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine has a molecular weight of 212.24 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-difluorophenyl)methyl]-N-methylazetidin-3-amine is sourced from PubChem (CID 66188228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).