N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine

C15H14F3NO — CID 62916540

IUPACN-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine
SMILESCNC(c1ccccc1)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C15H14F3NO/c1-19-14(11-6-3-2-4-7-11)12-8-5-9-13(10-12)20-15(16,17)18/h2-10,14,19H,1H3
InChIKeyHRUYMQHNUCDPRL-UHFFFAOYSA-N
MW281.28 g/mol
LogP3.89
Rot. Bonds4

About N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine

N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine (PubChem CID 62916540) has the molecular formula C15H14F3NO and a molecular weight of 281.28 g/mol. Its IUPAC name is N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine
PubChem CID62916540
Molecular FormulaC15H14F3NO
Molecular Weight281.28 g/mol
Exact Mass281.10
IUPAC NameN-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine
SMILESCNC(c1ccccc1)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C15H14F3NO/c1-19-14(11-6-3-2-4-7-11)12-8-5-9-13(10-12)20-15(16,17)18/h2-10,14,19H,1H3
InChIKeyHRUYMQHNUCDPRL-UHFFFAOYSA-N
XLogP3.89
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 ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromofuran-3-yl)-N-methyl-1-[3-(trifluoromethoxy)phenyl]methanamine
CID 106857562
1-(3-chloro-2-pyridinyl)-N-methyl-1-[3-(trifluoromethoxy)phenyl]methanamine
CID 103444046
N-methyl-1-(3-methyl-2-pyridinyl)-1-[3-(trifluoromethoxy)phenyl]methanamine
CID 62916892
N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-[3-(trifluoromethoxy)phenyl]methanamine
CID 105145906
1-(3-methoxyphenyl)-N-methyl-1-[4-(trifluoromethyl)phenyl]methanamine
CID 62791846
N-methyl-2-propan-2-yloxy-1-[3-(trifluoromethoxy)phenyl]ethanamine
CID 105145817
2-ethyl-2-methoxy-N-methyl-1-[3-(trifluoromethoxy)phenyl]butan-1-amine
CID 116761004
N-methyl-1-[3-(trifluoromethoxy)phenyl]pent-4-yn-1-amine
CID 112749243
(2R)-2-[3-(trifluoromethoxy)phenyl]propanoic acid
CID 175718270
(1R)-2,2,2-trideuterio-1-[3-(trifluoromethoxy)phenyl]ethanamine
CID 156699931
3-(methylamino)-1-[3-(trifluoromethoxy)phenyl]propane-1,2-diol
CID 171858529
1-[3-(difluoromethoxy)phenyl]-1-(3-ethylphenyl)-N-methylmethanamine
CID 105018727

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine?
The IUPAC name of N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine (CID 62916540) is N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine.
What is the SMILES notation for N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine?
The canonical SMILES for N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine is CNC(c1ccccc1)c1cccc(OC(F)(F)F)c1.
What is the InChIKey of N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine?
The InChIKey is HRUYMQHNUCDPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3NO/c1-19-14(11-6-3-2-4-7-11)12-8-5-9-13(10-12)20-15(16,17)18/h2-10,14,19H,1H3.
What are the key properties of N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine?
N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine has a molecular weight of 281.28 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenyl-1-[3-(trifluoromethoxy)phenyl]methanamine is sourced from PubChem (CID 62916540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).