6-ethyl-4-fluoro-3,4-dihydropyridine

C7H10FN — CID 143491679

IUPAC6-ethyl-4-fluoro-3,4-dihydropyridine
SMILESCCC1=CC(F)CC=N1
InChIInChI=1S/C7H10FN/c1-2-7-5-6(8)3-4-9-7/h4-6H,2-3H2,1H3
InChIKeyIQQVGYKCJNCYTI-UHFFFAOYSA-N
MW127.16 g/mol
LogP2.09
Rot. Bonds1

About 6-ethyl-4-fluoro-3,4-dihydropyridine

6-ethyl-4-fluoro-3,4-dihydropyridine (PubChem CID 143491679) has the molecular formula C7H10FN and a molecular weight of 127.16 g/mol. Its IUPAC name is 6-ethyl-4-fluoro-3,4-dihydropyridine.

Molecular Properties

Compound Name6-ethyl-4-fluoro-3,4-dihydropyridine
PubChem CID143491679
Molecular FormulaC7H10FN
Molecular Weight127.16 g/mol
Exact Mass127.08
IUPAC Name6-ethyl-4-fluoro-3,4-dihydropyridine
SMILESCCC1=CC(F)CC=N1
InChIInChI=1S/C7H10FN/c1-2-7-5-6(8)3-4-9-7/h4-6H,2-3H2,1H3
InChIKeyIQQVGYKCJNCYTI-UHFFFAOYSA-N
XLogP2.09
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.16
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-fluoroethyl)-3H-pyridine-4-thione
CID 17996045
3-Fluoro-6-methyl-3,4-dihydropyridine
CID 89071510
6-Methyl-3-(trifluoromethyl)-3,4-dihydropyridine
CID 89130189
3-Methyl-6-(trifluoromethyl)-3,4-dihydropyridine
CID 89136331
6-Methyl-4-(trifluoromethyl)-3,4-dihydropyridine
CID 89822863
2-Fluoro-6-methyl-3,4-dihydropyridine
CID 117732618
3,5-Difluoro-6-methyl-3,4-dihydropyridine
CID 123445255
4-fluoro-4,6-dimethyl-3H-pyridine
CID 123929608
3-Fluoro-4,6-dimethyl-3,4-dihydropyridine
CID 129196332
3-Fluoro-2,6-dimethyl-3,4-dihydropyridine
CID 134593926
4-Methyl-6-(trifluoromethyl)-3,4-dihydropyridine
CID 135161345
4,6-Dimethyl-3-(trifluoromethyl)-3,4-dihydropyridine
CID 141794085

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-fluoro-3,4-dihydropyridine?
The IUPAC name of 6-ethyl-4-fluoro-3,4-dihydropyridine (CID 143491679) is 6-ethyl-4-fluoro-3,4-dihydropyridine.
What is the SMILES notation for 6-ethyl-4-fluoro-3,4-dihydropyridine?
The canonical SMILES for 6-ethyl-4-fluoro-3,4-dihydropyridine is CCC1=CC(F)CC=N1.
What is the InChIKey of 6-ethyl-4-fluoro-3,4-dihydropyridine?
The InChIKey is IQQVGYKCJNCYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN/c1-2-7-5-6(8)3-4-9-7/h4-6H,2-3H2,1H3.
What are the key properties of 6-ethyl-4-fluoro-3,4-dihydropyridine?
6-ethyl-4-fluoro-3,4-dihydropyridine has a molecular weight of 127.16 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-fluoro-3,4-dihydropyridine is sourced from PubChem (CID 143491679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).