N-ethenyl-4-(trifluoromethyl)pyridin-2-amine

C8H7F3N2 — CID 142379561

IUPACN-ethenyl-4-(trifluoromethyl)pyridin-2-amine
SMILESC=CNc1cc(C(F)(F)F)ccn1
InChIInChI=1S/C8H7F3N2/c1-2-12-7-5-6(3-4-13-7)8(9,10)11/h2-5H,1H2,(H,12,13)
InChIKeyHSZVHJOPHLWGMA-UHFFFAOYSA-N
MW188.15 g/mol
LogP2.66
Rot. Bonds2

About N-ethenyl-4-(trifluoromethyl)pyridin-2-amine

N-ethenyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 142379561) has the molecular formula C8H7F3N2 and a molecular weight of 188.15 g/mol. Its IUPAC name is N-ethenyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-ethenyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID142379561
Molecular FormulaC8H7F3N2
Molecular Weight188.15 g/mol
Exact Mass188.06
IUPAC NameN-ethenyl-4-(trifluoromethyl)pyridin-2-amine
SMILESC=CNc1cc(C(F)(F)F)ccn1
InChIInChI=1S/C8H7F3N2/c1-2-12-7-5-6(3-4-13-7)8(9,10)11/h2-5H,1H2,(H,12,13)
InChIKeyHSZVHJOPHLWGMA-UHFFFAOYSA-N
XLogP2.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.15
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-ethenyl-4-(trifluoromethyl)pyridin-2-amine (CID 142379561) is N-ethenyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-ethenyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-ethenyl-4-(trifluoromethyl)pyridin-2-amine is C=CNc1cc(C(F)(F)F)ccn1.
What is the InChIKey of N-ethenyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is HSZVHJOPHLWGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2/c1-2-12-7-5-6(3-4-13-7)8(9,10)11/h2-5H,1H2,(H,12,13).
What are the key properties of N-ethenyl-4-(trifluoromethyl)pyridin-2-amine?
N-ethenyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 188.15 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 142379561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).