(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine

C14H13F3N2 — CID 63556299

IUPAC(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine
SMILESCc1cccc(C(N)c2ccccc2C(F)(F)F)n1
InChIInChI=1S/C14H13F3N2/c1-9-5-4-8-12(19-9)13(18)10-6-2-3-7-11(10)14(15,16)17/h2-8,13H,18H2,1H3
InChIKeyZOHDHSMHNOIYBS-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.46
Rot. Bonds2

About (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine

(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine (PubChem CID 63556299) has the molecular formula C14H13F3N2 and a molecular weight of 266.27 g/mol. Its IUPAC name is (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine
PubChem CID63556299
Molecular FormulaC14H13F3N2
Molecular Weight266.27 g/mol
Exact Mass266.10
IUPAC Name(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine
SMILESCc1cccc(C(N)c2ccccc2C(F)(F)F)n1
InChIInChI=1S/C14H13F3N2/c1-9-5-4-8-12(19-9)13(18)10-6-2-3-7-11(10)14(15,16)17/h2-8,13H,18H2,1H3
InChIKeyZOHDHSMHNOIYBS-UHFFFAOYSA-N
XLogP3.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine (CID 63556299) is (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine is Cc1cccc(C(N)c2ccccc2C(F)(F)F)n1.
What is the InChIKey of (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine?
The InChIKey is ZOHDHSMHNOIYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2/c1-9-5-4-8-12(19-9)13(18)10-6-2-3-7-11(10)14(15,16)17/h2-8,13H,18H2,1H3.
What are the key properties of (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine?
(6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine has a molecular weight of 266.27 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-2-pyridinyl)-[2-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 63556299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).