6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine

C7H8F3N3 — CID 55271042

IUPAC6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine
SMILESNc1ccc(C(N)C(F)(F)F)nc1
InChIInChI=1S/C7H8F3N3/c8-7(9,10)6(12)5-2-1-4(11)3-13-5/h1-3,6H,11-12H2
InChIKeyFCIGTSCRZSZONH-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.23
Rot. Bonds1

About 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine

6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine (PubChem CID 55271042) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine
PubChem CID55271042
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine
SMILESNc1ccc(C(N)C(F)(F)F)nc1
InChIInChI=1S/C7H8F3N3/c8-7(9,10)6(12)5-2-1-4(11)3-13-5/h1-3,6H,11-12H2
InChIKeyFCIGTSCRZSZONH-UHFFFAOYSA-N
XLogP1.23
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-Diaminopyridine
CID 5918
2-Vinylpyridine
CID 7521
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
3-Aminopyridine
CID 10009
2-Pyridinemethanamine
CID 19509
2-Ethylpyridine
CID 7523
Betahistine Hydrochloride
CID 68643
Bis(2-pyridylmethyl)amine
CID 73759
Picoplatin
CID 177358
Pyridine-2-carbothioamide
CID 1549499
1-Pyridin-3-yl-1,4-diazepane
CID 10654891

Frequently Asked Questions

What is the IUPAC name of 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine?
The IUPAC name of 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine (CID 55271042) is 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine.
What is the SMILES notation for 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine?
The canonical SMILES for 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine is Nc1ccc(C(N)C(F)(F)F)nc1.
What is the InChIKey of 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine?
The InChIKey is FCIGTSCRZSZONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3/c8-7(9,10)6(12)5-2-1-4(11)3-13-5/h1-3,6H,11-12H2.
What are the key properties of 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine?
6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine has a molecular weight of 191.16 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine is sourced from PubChem (CID 55271042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).