6-(trifluoromethyl)-2H-pyridin-1-amine

C6H7F3N2 — CID 162552940

IUPAC6-(trifluoromethyl)-2H-pyridin-1-amine
SMILESNN1CC=CC=C1C(F)(F)F
InChIInChI=1S/C6H7F3N2/c7-6(8,9)5-3-1-2-4-11(5)10/h1-3H,4,10H2
InChIKeyPHZNCWCGRXKWCM-UHFFFAOYSA-N
MW164.13 g/mol
LogP1.18
Rot. Bonds

About 6-(trifluoromethyl)-2H-pyridin-1-amine

6-(trifluoromethyl)-2H-pyridin-1-amine (PubChem CID 162552940) has the molecular formula C6H7F3N2 and a molecular weight of 164.13 g/mol. Its IUPAC name is 6-(trifluoromethyl)-2H-pyridin-1-amine.

Molecular Properties

Compound Name6-(trifluoromethyl)-2H-pyridin-1-amine
PubChem CID162552940
Molecular FormulaC6H7F3N2
Molecular Weight164.13 g/mol
Exact Mass164.06
IUPAC Name6-(trifluoromethyl)-2H-pyridin-1-amine
SMILESNN1CC=CC=C1C(F)(F)F
InChIInChI=1S/C6H7F3N2/c7-6(8,9)5-3-1-2-4-11(5)10/h1-3H,4,10H2
InChIKeyPHZNCWCGRXKWCM-UHFFFAOYSA-N
XLogP1.18
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.13
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)-2H-pyridin-1-amine?
The IUPAC name of 6-(trifluoromethyl)-2H-pyridin-1-amine (CID 162552940) is 6-(trifluoromethyl)-2H-pyridin-1-amine.
What is the SMILES notation for 6-(trifluoromethyl)-2H-pyridin-1-amine?
The canonical SMILES for 6-(trifluoromethyl)-2H-pyridin-1-amine is NN1CC=CC=C1C(F)(F)F.
What is the InChIKey of 6-(trifluoromethyl)-2H-pyridin-1-amine?
The InChIKey is PHZNCWCGRXKWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3N2/c7-6(8,9)5-3-1-2-4-11(5)10/h1-3H,4,10H2.
What are the key properties of 6-(trifluoromethyl)-2H-pyridin-1-amine?
6-(trifluoromethyl)-2H-pyridin-1-amine has a molecular weight of 164.13 g/mol, XLogP of 1.18, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)-2H-pyridin-1-amine is sourced from PubChem (CID 162552940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).