3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine

C14H12FN — CID 173227093

IUPAC3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine
SMILESC/C=C(\F)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C14H12FN/c1-2-14(15)12-7-5-11(6-8-12)13-4-3-9-16-10-13/h2-10H,1H3/b14-2-
InChIKeyRGZCFXVIGCSDFB-VVHNFQOZSA-N
MW213.25 g/mol
LogP4.08
Rot. Bonds2

About 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine

3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine (PubChem CID 173227093) has the molecular formula C14H12FN and a molecular weight of 213.25 g/mol. Its IUPAC name is 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine.

Molecular Properties

Compound Name3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine
PubChem CID173227093
Molecular FormulaC14H12FN
Molecular Weight213.25 g/mol
Exact Mass213.10
IUPAC Name3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine
SMILESC/C=C(\F)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C14H12FN/c1-2-14(15)12-7-5-11(6-8-12)13-4-3-9-16-10-13/h2-10H,1H3/b14-2-
InChIKeyRGZCFXVIGCSDFB-VVHNFQOZSA-N
XLogP4.08
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.25
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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bis(2-methylpropane);3-pyridin-3-ylpyridine
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CID 141390156
CID 147291067
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Frequently Asked Questions

What is the IUPAC name of 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine?
The IUPAC name of 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine (CID 173227093) is 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine.
What is the SMILES notation for 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine?
The canonical SMILES for 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine is C/C=C(\F)c1ccc(-c2cccnc2)cc1.
What is the InChIKey of 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine?
The InChIKey is RGZCFXVIGCSDFB-VVHNFQOZSA-N. The full InChI is InChI=1S/C14H12FN/c1-2-14(15)12-7-5-11(6-8-12)13-4-3-9-16-10-13/h2-10H,1H3/b14-2-.
What are the key properties of 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine?
3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine has a molecular weight of 213.25 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(Z)-1-fluoroprop-1-enyl]phenyl]pyridine is sourced from PubChem (CID 173227093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).