4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine

C14H13F2N — CID 134189088

IUPAC4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine
SMILESCc1cccc(F)c1CCc1cnccc1F
InChIInChI=1S/C14H13F2N/c1-10-3-2-4-14(16)12(10)6-5-11-9-17-8-7-13(11)15/h2-4,7-9H,5-6H2,1H3
InChIKeyMTCYBMJVIFUMIC-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.45
Rot. Bonds3

About 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine

4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine (PubChem CID 134189088) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine.

Molecular Properties

Compound Name4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine
PubChem CID134189088
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine
SMILESCc1cccc(F)c1CCc1cnccc1F
InChIInChI=1S/C14H13F2N/c1-10-3-2-4-14(16)12(10)6-5-11-9-17-8-7-13(11)15/h2-4,7-9H,5-6H2,1H3
InChIKeyMTCYBMJVIFUMIC-UHFFFAOYSA-N
XLogP3.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chloropropyl)-1-fluoro-3-methylbenzene
CID 118802920
1,3-difluoro-2-methylbenzene;3-fluoro-4-methylpyridine;1,2-xylene
CID 160980861
3-[[6-[2-(2-fluoro-6-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 58442097
3-(2-fluorophenyl)-4-methylpyridine
CID 46313062
1-(2-fluoro-6-methylphenyl)propan-2-one
CID 84765067
2-(2,2-dimethylpropyl)-1-fluoro-3-methylbenzene
CID 58149351
2-(2,2-difluoroethyl)-1-fluoro-3-methylbenzene
CID 166898375
1-[2-(2-fluoro-6-methylphenyl)ethyl]cyclopropan-1-amine
CID 105447363
3-[2-(2,6-difluorophenyl)ethyl]pyridin-2-amine
CID 114934293
[2-(2-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105206960
3-(2-chloroethyl)-4-methylpyridine
CID 65438533
4-[(2-fluorophenyl)methyl]pyridine
CID 23294432

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine?
The IUPAC name of 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine (CID 134189088) is 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine.
What is the SMILES notation for 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine?
The canonical SMILES for 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine is Cc1cccc(F)c1CCc1cnccc1F.
What is the InChIKey of 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine?
The InChIKey is MTCYBMJVIFUMIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-10-3-2-4-14(16)12(10)6-5-11-9-17-8-7-13(11)15/h2-4,7-9H,5-6H2,1H3.
What are the key properties of 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine?
4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine has a molecular weight of 233.26 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-[2-(2-fluoro-6-methylphenyl)ethyl]pyridine is sourced from PubChem (CID 134189088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).