N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine

C13H12F3N3 — CID 82812363

IUPACN-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESCC(Nc1ccc(C(F)(F)F)nc1)c1ccncc1
InChIInChI=1S/C13H12F3N3/c1-9(10-4-6-17-7-5-10)19-11-2-3-12(18-8-11)13(14,15)16/h2-9,19H,1H3
InChIKeyAIQZSTBGCFOETM-UHFFFAOYSA-N
MW267.25 g/mol
LogP3.67
Rot. Bonds3

About N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine

N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 82812363) has the molecular formula C13H12F3N3 and a molecular weight of 267.25 g/mol. Its IUPAC name is N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine
PubChem CID82812363
Molecular FormulaC13H12F3N3
Molecular Weight267.25 g/mol
Exact Mass267.10
IUPAC NameN-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESCC(Nc1ccc(C(F)(F)F)nc1)c1ccncc1
InChIInChI=1S/C13H12F3N3/c1-9(10-4-6-17-7-5-10)19-11-2-3-12(18-8-11)13(14,15)16/h2-9,19H,1H3
InChIKeyAIQZSTBGCFOETM-UHFFFAOYSA-N
XLogP3.67
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-iodophenyl)ethyl]-6-(trifluoromethyl)pyridin-3-amine
CID 82812139
4-[1-[[6-(trifluoromethyl)-3-pyridinyl]amino]ethyl]benzonitrile
CID 82795079
4-fluoro-N-(1-pyridin-4-ylethyl)-3-(trifluoromethyl)aniline
CID 61227454
2-methyl-3-[[6-(trifluoromethyl)-3-pyridinyl]amino]butan-2-ol
CID 82811107
N-pentan-2-yl-6-(trifluoromethyl)pyridin-3-amine
CID 82810705
N-[1-(1-methylcyclopropyl)ethyl]-6-(trifluoromethyl)pyridin-3-amine
CID 82811659
N-(1-pyridin-4-ylethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 66328268
4-ethyl-N-(1-pyridin-4-ylethyl)aniline
CID 43195541
4-nitro-N-(1-pyridin-4-ylethyl)aniline
CID 43396000
2-methyl-N-[6-(trifluoromethyl)-3-pyridinyl]propanamide
CID 82706557
5-(1-iodoethyl)-2-(trifluoromethyl)pyridine
CID 142294771
N-(1-pyridin-4-ylethyl)-1-[4-(trifluoromethyl)phenyl]ethanamine
CID 43202288

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine (CID 82812363) is N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine is CC(Nc1ccc(C(F)(F)F)nc1)c1ccncc1.
What is the InChIKey of N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is AIQZSTBGCFOETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F3N3/c1-9(10-4-6-17-7-5-10)19-11-2-3-12(18-8-11)13(14,15)16/h2-9,19H,1H3.
What are the key properties of N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine?
N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 267.25 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-4-ylethyl)-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 82812363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).