(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine

C14H13F3N2 — CID 115374254

IUPAC(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
SMILESCc1cncc(C(N)c2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C14H13F3N2/c1-9-5-11(8-19-7-9)13(18)10-3-2-4-12(6-10)14(15,16)17/h2-8,13H,18H2,1H3
InChIKeyDZIHREICGFCZTG-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.46
Rot. Bonds2

About (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine

(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine (PubChem CID 115374254) has the molecular formula C14H13F3N2 and a molecular weight of 266.27 g/mol. Its IUPAC name is (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
PubChem CID115374254
Molecular FormulaC14H13F3N2
Molecular Weight266.27 g/mol
Exact Mass266.10
IUPAC Name(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
SMILESCc1cncc(C(N)c2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C14H13F3N2/c1-9-5-11(8-19-7-9)13(18)10-3-2-4-12(6-10)14(15,16)17/h2-8,13H,18H2,1H3
InChIKeyDZIHREICGFCZTG-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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Related Compounds

(R)-pyridin-3-yl-[3-(trifluoromethyl)phenyl]methanamine
CID 28502674
(2,6-dimethyl-4-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 107503114
(S)-[3-(trifluoromethyl)phenyl]-[4-(trifluoromethyl)phenyl]methanamine
CID 170898673
(4-fluoro-3,5-dimethylphenyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 65299620
(5-methylthiophen-3-yl)-[3-(trifluoromethyl)phenyl]methanamine
CID 65105009
(4-fluorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 115374243
(1S)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 7023585
(3,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 107974770
(2-bromo-5-methylphenyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 115850757
[[2-fluoro-5-(trifluoromethyl)phenyl]-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105250235
(3,5-dimethylthiophen-2-yl)-[3-(trifluoromethyl)phenyl]methanamine
CID 81157473
(1,3-dimethylpyrazol-4-yl)-[3-(trifluoromethyl)phenyl]methanamine
CID 102803479

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine (CID 115374254) is (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine is Cc1cncc(C(N)c2cccc(C(F)(F)F)c2)c1.
What is the InChIKey of (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine?
The InChIKey is DZIHREICGFCZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2/c1-9-5-11(8-19-7-9)13(18)10-3-2-4-12(6-10)14(15,16)17/h2-8,13H,18H2,1H3.
What are the key properties of (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine?
(5-methyl-3-pyridinyl)-[3-(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 (5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 115374254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).