N-(2,2-difluoropropyl)-N-methylazetidin-3-amine

C7H14F2N2 — CID 84651854

IUPACN-(2,2-difluoropropyl)-N-methylazetidin-3-amine
SMILESCN(CC(C)(F)F)C1CNC1
InChIInChI=1S/C7H14F2N2/c1-7(8,9)5-11(2)6-3-10-4-6/h6,10H,3-5H2,1-2H3
InChIKeyZMTGHIBLCZLQKP-UHFFFAOYSA-N
MW164.20 g/mol
LogP0.55
Rot. Bonds3

About N-(2,2-difluoropropyl)-N-methylazetidin-3-amine

N-(2,2-difluoropropyl)-N-methylazetidin-3-amine (PubChem CID 84651854) has the molecular formula C7H14F2N2 and a molecular weight of 164.20 g/mol. Its IUPAC name is N-(2,2-difluoropropyl)-N-methylazetidin-3-amine.

Molecular Properties

Compound NameN-(2,2-difluoropropyl)-N-methylazetidin-3-amine
PubChem CID84651854
Molecular FormulaC7H14F2N2
Molecular Weight164.20 g/mol
Exact Mass164.11
IUPAC NameN-(2,2-difluoropropyl)-N-methylazetidin-3-amine
SMILESCN(CC(C)(F)F)C1CNC1
InChIInChI=1S/C7H14F2N2/c1-7(8,9)5-11(2)6-3-10-4-6/h6,10H,3-5H2,1-2H3
InChIKeyZMTGHIBLCZLQKP-UHFFFAOYSA-N
XLogP0.55
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine
CID 66186139
1-tert-butyl-N-(2,2-difluoropropyl)-N-methylpiperidin-4-amine
CID 118531508
methyl 3-[azetidin-3-yl(methyl)amino]-2,2-dimethylpropanoate
CID 79619984
N-(2,2-difluoroethyl)-N-methylazetidin-3-amine;ethane
CID 145168742
1-[azetidin-3-yl(methyl)amino]-3-fluoropropan-2-ol
CID 131219839
N-methyl-N-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43607421
ethane;N-methyl-N-propylazetidin-3-amine
CID 144899605
N-methyl-N-prop-2-ynylazetidin-3-amine
CID 66185274
4-[[azetidin-3-yl(methyl)amino]methyl]piperidin-4-ol
CID 126846975
N-methyl-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]azetidin-3-amine
CID 120857759
N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride
CID 90259041
N-ethyl-N-(4,4,4-trifluorobutyl)azetidin-3-amine
CID 115514933

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoropropyl)-N-methylazetidin-3-amine?
The IUPAC name of N-(2,2-difluoropropyl)-N-methylazetidin-3-amine (CID 84651854) is N-(2,2-difluoropropyl)-N-methylazetidin-3-amine.
What is the SMILES notation for N-(2,2-difluoropropyl)-N-methylazetidin-3-amine?
The canonical SMILES for N-(2,2-difluoropropyl)-N-methylazetidin-3-amine is CN(CC(C)(F)F)C1CNC1.
What is the InChIKey of N-(2,2-difluoropropyl)-N-methylazetidin-3-amine?
The InChIKey is ZMTGHIBLCZLQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2N2/c1-7(8,9)5-11(2)6-3-10-4-6/h6,10H,3-5H2,1-2H3.
What are the key properties of N-(2,2-difluoropropyl)-N-methylazetidin-3-amine?
N-(2,2-difluoropropyl)-N-methylazetidin-3-amine has a molecular weight of 164.20 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoropropyl)-N-methylazetidin-3-amine is sourced from PubChem (CID 84651854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).