2-chloro-3-(difluoromethyl)-5-ethylpyridine

C8H8ClF2N — CID 105445604

IUPAC2-chloro-3-(difluoromethyl)-5-ethylpyridine
SMILESCCc1cnc(Cl)c(C(F)F)c1
InChIInChI=1S/C8H8ClF2N/c1-2-5-3-6(8(10)11)7(9)12-4-5/h3-4,8H,2H2,1H3
InChIKeyHLYNYOBGGQKPCK-UHFFFAOYSA-N
MW191.61 g/mol
LogP3.23
Rot. Bonds2

About 2-chloro-3-(difluoromethyl)-5-ethylpyridine

2-chloro-3-(difluoromethyl)-5-ethylpyridine (PubChem CID 105445604) has the molecular formula C8H8ClF2N and a molecular weight of 191.61 g/mol. Its IUPAC name is 2-chloro-3-(difluoromethyl)-5-ethylpyridine.

Molecular Properties

Compound Name2-chloro-3-(difluoromethyl)-5-ethylpyridine
PubChem CID105445604
Molecular FormulaC8H8ClF2N
Molecular Weight191.61 g/mol
Exact Mass191.03
IUPAC Name2-chloro-3-(difluoromethyl)-5-ethylpyridine
SMILESCCc1cnc(Cl)c(C(F)F)c1
InChIInChI=1S/C8H8ClF2N/c1-2-5-3-6(8(10)11)7(9)12-4-5/h3-4,8H,2H2,1H3
InChIKeyHLYNYOBGGQKPCK-UHFFFAOYSA-N
XLogP3.23
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.61
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,3-dichloro-5-ethylpyridine
CID 20678674
2-chloro-5-ethylpyridine-3-carbonitrile
CID 14569539
3-chloro-5-ethyl-2-propan-2-yloxypyridine
CID 90064685
2-chloro-5-ethylpyridine-3-carboxamide
CID 123601830
2-chloro-5-ethylpyrimidine
CID 3572763
[5-(difluoromethyl)-6-methyl-3-pyridinyl]methanamine
CID 130097556
[5-(difluoromethyl)-6-methyl-3-pyridinyl]methanol
CID 130097700
2-chloro-3-(chloromethyl)-5-(difluoromethyl)-4-methylpyridine
CID 119006119
2-(difluoromethyl)-1,4-diethylbenzene
CID 143346890
2-cyclopropyl-5-ethyl-3-propan-2-ylpyridine
CID 137409439
3-(difluoromethyl)-2-ethyl-5-fluoropyridine
CID 173055715
5-ethyl-2-propan-2-ylpyrimidine
CID 58333368

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(difluoromethyl)-5-ethylpyridine?
The IUPAC name of 2-chloro-3-(difluoromethyl)-5-ethylpyridine (CID 105445604) is 2-chloro-3-(difluoromethyl)-5-ethylpyridine.
What is the SMILES notation for 2-chloro-3-(difluoromethyl)-5-ethylpyridine?
The canonical SMILES for 2-chloro-3-(difluoromethyl)-5-ethylpyridine is CCc1cnc(Cl)c(C(F)F)c1.
What is the InChIKey of 2-chloro-3-(difluoromethyl)-5-ethylpyridine?
The InChIKey is HLYNYOBGGQKPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClF2N/c1-2-5-3-6(8(10)11)7(9)12-4-5/h3-4,8H,2H2,1H3.
What are the key properties of 2-chloro-3-(difluoromethyl)-5-ethylpyridine?
2-chloro-3-(difluoromethyl)-5-ethylpyridine has a molecular weight of 191.61 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(difluoromethyl)-5-ethylpyridine is sourced from PubChem (CID 105445604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).