N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine

C14H13F3N2 — CID 2990515

IUPACN-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccc(NCCc2ccccc2)nc1
InChIInChI=1S/C14H13F3N2/c15-14(16,17)12-6-7-13(19-10-12)18-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyOXVBDWQZFXYFOC-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.76
Rot. Bonds4

About N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine

N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 2990515) has the molecular formula C14H13F3N2 and a molecular weight of 266.27 g/mol. Its IUPAC name is N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID2990515
Molecular FormulaC14H13F3N2
Molecular Weight266.27 g/mol
Exact Mass266.10
IUPAC NameN-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccc(NCCc2ccccc2)nc1
InChIInChI=1S/C14H13F3N2/c15-14(16,17)12-6-7-13(19-10-12)18-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19)
InChIKeyOXVBDWQZFXYFOC-UHFFFAOYSA-N
XLogP3.76
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine (CID 2990515) is N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1ccc(NCCc2ccccc2)nc1.
What is the InChIKey of N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is OXVBDWQZFXYFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2/c15-14(16,17)12-6-7-13(19-10-12)18-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,19).
What are the key properties of N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine?
N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 266.27 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 2990515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).