(5-ethenyl-6-fluoro-2-pyridinyl)methanol

C8H8FNO — CID 74892678

IUPAC(5-ethenyl-6-fluoro-2-pyridinyl)methanol
SMILESC=Cc1ccc(CO)nc1F
InChIInChI=1S/C8H8FNO/c1-2-6-3-4-7(5-11)10-8(6)9/h2-4,11H,1,5H2
InChIKeyBMHXQZXRJYIRBY-UHFFFAOYSA-N
MW153.16 g/mol
LogP1.36
Rot. Bonds2

About (5-ethenyl-6-fluoro-2-pyridinyl)methanol

(5-ethenyl-6-fluoro-2-pyridinyl)methanol (PubChem CID 74892678) has the molecular formula C8H8FNO and a molecular weight of 153.16 g/mol. Its IUPAC name is (5-ethenyl-6-fluoro-2-pyridinyl)methanol.

Molecular Properties

Compound Name(5-ethenyl-6-fluoro-2-pyridinyl)methanol
PubChem CID74892678
Molecular FormulaC8H8FNO
Molecular Weight153.16 g/mol
Exact Mass153.06
IUPAC Name(5-ethenyl-6-fluoro-2-pyridinyl)methanol
SMILESC=Cc1ccc(CO)nc1F
InChIInChI=1S/C8H8FNO/c1-2-6-3-4-7(5-11)10-8(6)9/h2-4,11H,1,5H2
InChIKeyBMHXQZXRJYIRBY-UHFFFAOYSA-N
XLogP1.36
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.16
LogP ≤ 51.36
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 (5-ethenyl-6-fluoro-2-pyridinyl)methanol?
The IUPAC name of (5-ethenyl-6-fluoro-2-pyridinyl)methanol (CID 74892678) is (5-ethenyl-6-fluoro-2-pyridinyl)methanol.
What is the SMILES notation for (5-ethenyl-6-fluoro-2-pyridinyl)methanol?
The canonical SMILES for (5-ethenyl-6-fluoro-2-pyridinyl)methanol is C=Cc1ccc(CO)nc1F.
What is the InChIKey of (5-ethenyl-6-fluoro-2-pyridinyl)methanol?
The InChIKey is BMHXQZXRJYIRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO/c1-2-6-3-4-7(5-11)10-8(6)9/h2-4,11H,1,5H2.
What are the key properties of (5-ethenyl-6-fluoro-2-pyridinyl)methanol?
(5-ethenyl-6-fluoro-2-pyridinyl)methanol has a molecular weight of 153.16 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethenyl-6-fluoro-2-pyridinyl)methanol is sourced from PubChem (CID 74892678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).