[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine

C15H14F3N — CID 156612413

IUPAC[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine
SMILESCc1ccc(-c2cc(CN)cc(C(F)(F)F)c2)cc1
InChIInChI=1S/C15H14F3N/c1-10-2-4-12(5-3-10)13-6-11(9-19)7-14(8-13)15(16,17)18/h2-8H,9,19H2,1H3
InChIKeyHUBZCTWJKTXFFJ-UHFFFAOYSA-N
MW265.28 g/mol
LogP4.14
Rot. Bonds2

About [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine

[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine (PubChem CID 156612413) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine
PubChem CID156612413
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine
SMILESCc1ccc(-c2cc(CN)cc(C(F)(F)F)c2)cc1
InChIInChI=1S/C15H14F3N/c1-10-2-4-12(5-3-10)13-6-11(9-19)7-14(8-13)15(16,17)18/h2-8H,9,19H2,1H3
InChIKeyHUBZCTWJKTXFFJ-UHFFFAOYSA-N
XLogP4.14
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-[3,5-bis(trifluoromethyl)phenyl]-5-(trifluoromethyl)phenyl]methanamine
CID 118342936
[3-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]methanamine
CID 129154957
[3-methyl-5-[3-(trifluoromethyl)phenyl]phenyl]methanamine;hydrochloride
CID 166611051
[3-(4-phenylmethoxyphenyl)-5-(trifluoromethyl)phenyl]methanamine
CID 156612416
[3-(3-methoxyphenyl)-5-(trifluoromethyl)phenyl]methanamine
CID 156612409
1-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]-3,5-bis(trifluoromethyl)benzene
CID 163216983
[3-[3-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)phenyl]methanamine
CID 156612410
1-methyl-4-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]benzene
CID 59630308
2-[4-[3-ethyl-5-(trifluoromethyl)phenyl]phenyl]-6-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalene
CID 170293712
1-methyl-3-phenyl-5-(trifluoromethyl)benzene
CID 46315073
[3-(4-methylphenyl)phenyl]methanamine
CID 1392243
[3-ethylsulfonyl-5-(trifluoromethyl)phenyl]methanamine
CID 112594413

Frequently Asked Questions

What is the IUPAC name of [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine (CID 156612413) is [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine is Cc1ccc(-c2cc(CN)cc(C(F)(F)F)c2)cc1.
What is the InChIKey of [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine?
The InChIKey is HUBZCTWJKTXFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c1-10-2-4-12(5-3-10)13-6-11(9-19)7-14(8-13)15(16,17)18/h2-8H,9,19H2,1H3.
What are the key properties of [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine?
[3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine has a molecular weight of 265.28 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methylphenyl)-5-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 156612413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).