(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine

C8H9F3N2 — CID 97053211

IUPAC(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccnc(C(F)(F)F)c1
InChIInChI=1S/C8H9F3N2/c1-5(12)6-2-3-13-7(4-6)8(9,10)11/h2-5H,12H2,1H3/t5-/m1/s1
InChIKeyHINKKEGFYGRYTJ-RXMQYKEDSA-N
MW190.17 g/mol
LogP2.12
Rot. Bonds1

About (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine

(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine (PubChem CID 97053211) has the molecular formula C8H9F3N2 and a molecular weight of 190.17 g/mol. Its IUPAC name is (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine
PubChem CID97053211
Molecular FormulaC8H9F3N2
Molecular Weight190.17 g/mol
Exact Mass190.07
IUPAC Name(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccnc(C(F)(F)F)c1
InChIInChI=1S/C8H9F3N2/c1-5(12)6-2-3-13-7(4-6)8(9,10)11/h2-5H,12H2,1H3/t5-/m1/s1
InChIKeyHINKKEGFYGRYTJ-RXMQYKEDSA-N
XLogP2.12
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethionamide
CID 2761171
Anabasine
CID 205586
Nornicotine
CID 91462
Prothionamide
CID 666418
3-(Pyrrolidin-2-yl)pyridine
CID 412
(+-)-Anabasine
CID 2181
Myosmine
CID 442649
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985
Rivanicline
CID 5310967

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine?
The IUPAC name of (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine (CID 97053211) is (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine.
What is the SMILES notation for (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine?
The canonical SMILES for (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine is C[C@@H](N)c1ccnc(C(F)(F)F)c1.
What is the InChIKey of (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine?
The InChIKey is HINKKEGFYGRYTJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H9F3N2/c1-5(12)6-2-3-13-7(4-6)8(9,10)11/h2-5H,12H2,1H3/t5-/m1/s1.
What are the key properties of (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine?
(1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine has a molecular weight of 190.17 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(trifluoromethyl)-4-pyridinyl]ethanamine is sourced from PubChem (CID 97053211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).