N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine

C15H14F3NO — CID 43282524

IUPACN-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
SMILESCNCc1ccccc1Oc1ccccc1C(F)(F)F
InChIInChI=1S/C15H14F3NO/c1-19-10-11-6-2-4-8-13(11)20-14-9-5-3-7-12(14)15(16,17)18/h2-9,19H,10H2,1H3
InChIKeyUIPZDKUQGCMJFR-UHFFFAOYSA-N
MW281.28 g/mol
LogP4.22
Rot. Bonds4

About N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine

N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine (PubChem CID 43282524) has the molecular formula C15H14F3NO and a molecular weight of 281.28 g/mol. Its IUPAC name is N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
PubChem CID43282524
Molecular FormulaC15H14F3NO
Molecular Weight281.28 g/mol
Exact Mass281.10
IUPAC NameN-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
SMILESCNCc1ccccc1Oc1ccccc1C(F)(F)F
InChIInChI=1S/C15H14F3NO/c1-19-10-11-6-2-4-8-13(11)20-14-9-5-3-7-12(14)15(16,17)18/h2-9,19H,10H2,1H3
InChIKeyUIPZDKUQGCMJFR-UHFFFAOYSA-N
XLogP4.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[2-[[2-(trifluoromethyl)phenoxy]methyl]phenyl]methanamine
CID 62449458
N-methyl-1-[2-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 14509279
1-[2-(2-ethylphenoxy)phenyl]-N-methylmethanamine
CID 43283795
N-methyl-1-[4-methyl-3-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 105406518
1-[2-(2-tert-butylphenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 43314125
1-[3-fluoro-5-[2-(trifluoromethyl)phenoxy]phenyl]-N-methylmethanamine
CID 106531188
N-methyl-1-[2-methyl-3-(trifluoromethyl)phenyl]methanamine
CID 155749063
N-methyl-1-[2-[4-(trifluoromethyl)pyrimidin-2-yl]oxyphenyl]methanamine
CID 106485491
N-methyl-1-[5-methyl-6-[2-(trifluoromethyl)phenoxy]-3-pyridinyl]methanamine
CID 80637413
1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
CID 43282384
1-[(2-methoxyphenyl)methyl]-2-[[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 57251880
1-[3-(2-tert-butylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 105075212

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine?
The IUPAC name of N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine (CID 43282524) is N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine?
The canonical SMILES for N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine is CNCc1ccccc1Oc1ccccc1C(F)(F)F.
What is the InChIKey of N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine?
The InChIKey is UIPZDKUQGCMJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3NO/c1-19-10-11-6-2-4-8-13(11)20-14-9-5-3-7-12(14)15(16,17)18/h2-9,19H,10H2,1H3.
What are the key properties of N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine?
N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine has a molecular weight of 281.28 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine is sourced from PubChem (CID 43282524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).