6-fluoro-2,3-dihydropyridine

C5H6FN — CID 145228643

IUPAC6-fluoro-2,3-dihydropyridine
SMILESFC1=NCCC=C1
InChIInChI=1S/C5H6FN/c6-5-3-1-2-4-7-5/h1,3H,2,4H2
InChIKeyJWPMXMPNXAVNTH-UHFFFAOYSA-N
MW99.11 g/mol
LogP1.31
Rot. Bonds

About 6-fluoro-2,3-dihydropyridine

6-fluoro-2,3-dihydropyridine (PubChem CID 145228643) has the molecular formula C5H6FN and a molecular weight of 99.11 g/mol. Its IUPAC name is 6-fluoro-2,3-dihydropyridine.

Molecular Properties

Compound Name6-fluoro-2,3-dihydropyridine
PubChem CID145228643
Molecular FormulaC5H6FN
Molecular Weight99.11 g/mol
Exact Mass99.05
IUPAC Name6-fluoro-2,3-dihydropyridine
SMILESFC1=NCCC=C1
InChIInChI=1S/C5H6FN/c6-5-3-1-2-4-7-5/h1,3H,2,4H2
InChIKeyJWPMXMPNXAVNTH-UHFFFAOYSA-N
XLogP1.31
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.11
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-fluoro-2,3-dihydropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 13347754
CID 13347754
CID 54085820
CID 54085820
CID 57109378
CID 57109378
CID 57288424
CID 57288424
CID 68024004
CID 68024004
CID 89932263
CID 89932263
CID 90015073
CID 90015073
CID 90015074
CID 90015074
CID 90926903
CID 90926903
CID 91143792
CID 91143792
CID 123887504
CID 123887504
CID 123919099
CID 123919099

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,3-dihydropyridine?
The IUPAC name of 6-fluoro-2,3-dihydropyridine (CID 145228643) is 6-fluoro-2,3-dihydropyridine.
What is the SMILES notation for 6-fluoro-2,3-dihydropyridine?
The canonical SMILES for 6-fluoro-2,3-dihydropyridine is FC1=NCCC=C1.
What is the InChIKey of 6-fluoro-2,3-dihydropyridine?
The InChIKey is JWPMXMPNXAVNTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FN/c6-5-3-1-2-4-7-5/h1,3H,2,4H2.
What are the key properties of 6-fluoro-2,3-dihydropyridine?
6-fluoro-2,3-dihydropyridine has a molecular weight of 99.11 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,3-dihydropyridine is sourced from PubChem (CID 145228643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).