5-[3-(trifluoromethyl)phenyl]pyridin-2-amine

C12H9F3N2 — CID 10243267

IUPAC5-[3-(trifluoromethyl)phenyl]pyridin-2-amine
SMILESNc1ccc(-c2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C12H9F3N2/c13-12(14,15)10-3-1-2-8(6-10)9-4-5-11(16)17-7-9/h1-7H,(H2,16,17)
InChIKeyHZNFABRHAXANIU-UHFFFAOYSA-N
MW238.21 g/mol
LogP3.35
Rot. Bonds1

About 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine

5-[3-(trifluoromethyl)phenyl]pyridin-2-amine (PubChem CID 10243267) has the molecular formula C12H9F3N2 and a molecular weight of 238.21 g/mol. Its IUPAC name is 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-(trifluoromethyl)phenyl]pyridin-2-amine
PubChem CID10243267
Molecular FormulaC12H9F3N2
Molecular Weight238.21 g/mol
Exact Mass238.07
IUPAC Name5-[3-(trifluoromethyl)phenyl]pyridin-2-amine
SMILESNc1ccc(-c2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C12H9F3N2/c13-12(14,15)10-3-1-2-8(6-10)9-4-5-11(16)17-7-9/h1-7H,(H2,16,17)
InChIKeyHZNFABRHAXANIU-UHFFFAOYSA-N
XLogP3.35
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.21
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine?
The IUPAC name of 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine (CID 10243267) is 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine.
What is the SMILES notation for 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine?
The canonical SMILES for 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine is Nc1ccc(-c2cccc(C(F)(F)F)c2)cn1.
What is the InChIKey of 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine?
The InChIKey is HZNFABRHAXANIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F3N2/c13-12(14,15)10-3-1-2-8(6-10)9-4-5-11(16)17-7-9/h1-7H,(H2,16,17).
What are the key properties of 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine?
5-[3-(trifluoromethyl)phenyl]pyridin-2-amine has a molecular weight of 238.21 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(trifluoromethyl)phenyl]pyridin-2-amine is sourced from PubChem (CID 10243267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).