2-ethenyl-5-fluoropyridine-4-carbaldehyde

C8H6FNO — CID 74891858

IUPAC2-ethenyl-5-fluoropyridine-4-carbaldehyde
SMILESC=Cc1cc(C=O)c(F)cn1
InChIInChI=1S/C8H6FNO/c1-2-7-3-6(5-11)8(9)4-10-7/h2-5H,1H2
InChIKeyDAMRGSLJWGWVHQ-UHFFFAOYSA-N
MW151.14 g/mol
LogP1.68
Rot. Bonds2

About 2-ethenyl-5-fluoropyridine-4-carbaldehyde

2-ethenyl-5-fluoropyridine-4-carbaldehyde (PubChem CID 74891858) has the molecular formula C8H6FNO and a molecular weight of 151.14 g/mol. Its IUPAC name is 2-ethenyl-5-fluoropyridine-4-carbaldehyde.

Molecular Properties

Compound Name2-ethenyl-5-fluoropyridine-4-carbaldehyde
PubChem CID74891858
Molecular FormulaC8H6FNO
Molecular Weight151.14 g/mol
Exact Mass151.04
IUPAC Name2-ethenyl-5-fluoropyridine-4-carbaldehyde
SMILESC=Cc1cc(C=O)c(F)cn1
InChIInChI=1S/C8H6FNO/c1-2-7-3-6(5-11)8(9)4-10-7/h2-5H,1H2
InChIKeyDAMRGSLJWGWVHQ-UHFFFAOYSA-N
XLogP1.68
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-fluoro-2-(3-hydroxyprop-1-ynyl)pyridine-4-carbaldehyde
CID 169485084
5-fluoro-4-formylpyridine-2-sulfonyl chloride
CID 162341912
5-fluoro-2-(trifluoromethoxy)pyridine-4-carbaldehyde
CID 130092237
2-(3-chloro-1,2-dihydroxypropyl)-5-fluoropyridine-4-carbaldehyde
CID 171862138
4-ethenyl-5-fluoro-2-methylpyridine
CID 74889088
4,6-difluorobenzene-1,3-dicarbaldehyde
CID 11030259
2-(2,5-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 133091145
4-ethenyl-2-fluorobenzaldehyde
CID 107430174
6-ethenylpyridine-3,4-diamine
CID 74891844
2-(3-chloro-2-fluorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 172868911
5-fluoro-2-[2-(trifluoromethyl)phenyl]pyridine-4-carbaldehyde
CID 133089617
4-(dimethylamino)-5-ethenyl-2-fluorobenzaldehyde
CID 145002079

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-5-fluoropyridine-4-carbaldehyde?
The IUPAC name of 2-ethenyl-5-fluoropyridine-4-carbaldehyde (CID 74891858) is 2-ethenyl-5-fluoropyridine-4-carbaldehyde.
What is the SMILES notation for 2-ethenyl-5-fluoropyridine-4-carbaldehyde?
The canonical SMILES for 2-ethenyl-5-fluoropyridine-4-carbaldehyde is C=Cc1cc(C=O)c(F)cn1.
What is the InChIKey of 2-ethenyl-5-fluoropyridine-4-carbaldehyde?
The InChIKey is DAMRGSLJWGWVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNO/c1-2-7-3-6(5-11)8(9)4-10-7/h2-5H,1H2.
What are the key properties of 2-ethenyl-5-fluoropyridine-4-carbaldehyde?
2-ethenyl-5-fluoropyridine-4-carbaldehyde has a molecular weight of 151.14 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-fluoropyridine-4-carbaldehyde is sourced from PubChem (CID 74891858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).