N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine

C22H20F3N — CID 134795231

IUPACN-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
SMILESCN(Cc1ccc(-c2ccccc2)cc1)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C22H20F3N/c1-26(16-18-9-13-21(14-10-18)22(23,24)25)15-17-7-11-20(12-8-17)19-5-3-2-4-6-19/h2-14H,15-16H2,1H3
InChIKeyUSWKLSDHFHSNBX-UHFFFAOYSA-N
MW355.40 g/mol
LogP6.00
Rot. Bonds5

About N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine

N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine (PubChem CID 134795231) has the molecular formula C22H20F3N and a molecular weight of 355.40 g/mol. Its IUPAC name is N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
PubChem CID134795231
Molecular FormulaC22H20F3N
Molecular Weight355.40 g/mol
Exact Mass355.15
IUPAC NameN-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
SMILESCN(Cc1ccc(-c2ccccc2)cc1)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C22H20F3N/c1-26(16-18-9-13-21(14-10-18)22(23,24)25)15-17-7-11-20(12-8-17)19-5-3-2-4-6-19/h2-14H,15-16H2,1H3
InChIKeyUSWKLSDHFHSNBX-UHFFFAOYSA-N
XLogP6.00
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.40
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine?
The IUPAC name of N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine (CID 134795231) is N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine.
What is the SMILES notation for N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine?
The canonical SMILES for N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine is CN(Cc1ccc(-c2ccccc2)cc1)Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine?
The InChIKey is USWKLSDHFHSNBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F3N/c1-26(16-18-9-13-21(14-10-18)22(23,24)25)15-17-7-11-20(12-8-17)19-5-3-2-4-6-19/h2-14H,15-16H2,1H3.
What are the key properties of N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine?
N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine has a molecular weight of 355.40 g/mol, XLogP of 6.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-phenylphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine is sourced from PubChem (CID 134795231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).