(4-ethenyl-6-fluoro-2-pyridinyl)methanamine

C8H9FN2 — CID 74892306

IUPAC(4-ethenyl-6-fluoro-2-pyridinyl)methanamine
SMILESC=Cc1cc(F)nc(CN)c1
InChIInChI=1S/C8H9FN2/c1-2-6-3-7(5-10)11-8(9)4-6/h2-4H,1,5,10H2
InChIKeyDJCAWYPIPNBJFA-UHFFFAOYSA-N
MW152.17 g/mol
LogP1.32
Rot. Bonds2

About (4-ethenyl-6-fluoro-2-pyridinyl)methanamine

(4-ethenyl-6-fluoro-2-pyridinyl)methanamine (PubChem CID 74892306) has the molecular formula C8H9FN2 and a molecular weight of 152.17 g/mol. Its IUPAC name is (4-ethenyl-6-fluoro-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-ethenyl-6-fluoro-2-pyridinyl)methanamine
PubChem CID74892306
Molecular FormulaC8H9FN2
Molecular Weight152.17 g/mol
Exact Mass152.07
IUPAC Name(4-ethenyl-6-fluoro-2-pyridinyl)methanamine
SMILESC=Cc1cc(F)nc(CN)c1
InChIInChI=1S/C8H9FN2/c1-2-6-3-7(5-10)11-8(9)4-6/h2-4H,1,5,10H2
InChIKeyDJCAWYPIPNBJFA-UHFFFAOYSA-N
XLogP1.32
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-ethenyl-6-fluoro-2-pyridinyl)methanamine?
The IUPAC name of (4-ethenyl-6-fluoro-2-pyridinyl)methanamine (CID 74892306) is (4-ethenyl-6-fluoro-2-pyridinyl)methanamine.
What is the SMILES notation for (4-ethenyl-6-fluoro-2-pyridinyl)methanamine?
The canonical SMILES for (4-ethenyl-6-fluoro-2-pyridinyl)methanamine is C=Cc1cc(F)nc(CN)c1.
What is the InChIKey of (4-ethenyl-6-fluoro-2-pyridinyl)methanamine?
The InChIKey is DJCAWYPIPNBJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2/c1-2-6-3-7(5-10)11-8(9)4-6/h2-4H,1,5,10H2.
What are the key properties of (4-ethenyl-6-fluoro-2-pyridinyl)methanamine?
(4-ethenyl-6-fluoro-2-pyridinyl)methanamine has a molecular weight of 152.17 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenyl-6-fluoro-2-pyridinyl)methanamine is sourced from PubChem (CID 74892306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).