[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine

C14H12F3NO — CID 19627404

IUPAC[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
SMILESNCc1ccccc1Oc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H12F3NO/c15-14(16,17)11-5-3-6-12(8-11)19-13-7-2-1-4-10(13)9-18/h1-8H,9,18H2
InChIKeyLPSQLJZBUCTCTG-UHFFFAOYSA-N
MW267.25 g/mol
LogP3.96
Rot. Bonds3

About [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine

[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine (PubChem CID 19627404) has the molecular formula C14H12F3NO and a molecular weight of 267.25 g/mol. Its IUPAC name is [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine.

Molecular Properties

Compound Name[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
PubChem CID19627404
Molecular FormulaC14H12F3NO
Molecular Weight267.25 g/mol
Exact Mass267.09
IUPAC Name[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
SMILESNCc1ccccc1Oc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H12F3NO/c15-14(16,17)11-5-3-6-12(8-11)19-13-7-2-1-4-10(13)9-18/h1-8H,9,18H2
InChIKeyLPSQLJZBUCTCTG-UHFFFAOYSA-N
XLogP3.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-fluoro-2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 63673150
[2-[3-(trifluoromethyl)phenoxy]phenyl]methanol
CID 3700252
[2-(3-methylphenoxy)-5-(trifluoromethyl)phenyl]methanamine
CID 43331214
methyl 2-[2-[3-[3-(trifluoromethyl)phenoxy]phenoxy]phenyl]acetate
CID 151514749
[2-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]methanamine
CID 43147467
[2-(3-bromophenoxy)phenyl]methanamine
CID 28966197
[3-[3-(trifluoromethyl)phenoxy]phenyl]methanamine;hydrochloride
CID 133056705
2-[3-(trifluoromethyl)phenoxy]benzenesulfonamide
CID 171049380
(2-naphthalen-2-yloxyphenyl)methanamine
CID 19627401
[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine
CID 63986542
ethyl 2-[3-(trifluoromethyl)phenoxy]benzoate
CID 133061108
[4-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]methanol
CID 81237603

Frequently Asked Questions

What is the IUPAC name of [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine?
The IUPAC name of [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine (CID 19627404) is [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine.
What is the SMILES notation for [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine?
The canonical SMILES for [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine is NCc1ccccc1Oc1cccc(C(F)(F)F)c1.
What is the InChIKey of [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine?
The InChIKey is LPSQLJZBUCTCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO/c15-14(16,17)11-5-3-6-12(8-11)19-13-7-2-1-4-10(13)9-18/h1-8H,9,18H2.
What are the key properties of [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine?
[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine has a molecular weight of 267.25 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine is sourced from PubChem (CID 19627404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).