3-bromo-5-chloro-4-ethylpyridine

C7H7BrClN — CID 148785357

IUPAC3-bromo-5-chloro-4-ethylpyridine
SMILESCCc1c(Cl)cncc1Br
InChIInChI=1S/C7H7BrClN/c1-2-5-6(8)3-10-4-7(5)9/h3-4H,2H2,1H3
InChIKeyOLCPJMYCYQNZCT-UHFFFAOYSA-N
MW220.50 g/mol
LogP3.06
Rot. Bonds1

About 3-bromo-5-chloro-4-ethylpyridine

3-bromo-5-chloro-4-ethylpyridine (PubChem CID 148785357) has the molecular formula C7H7BrClN and a molecular weight of 220.50 g/mol. Its IUPAC name is 3-bromo-5-chloro-4-ethylpyridine.

Molecular Properties

Compound Name3-bromo-5-chloro-4-ethylpyridine
PubChem CID148785357
Molecular FormulaC7H7BrClN
Molecular Weight220.50 g/mol
Exact Mass218.95
IUPAC Name3-bromo-5-chloro-4-ethylpyridine
SMILESCCc1c(Cl)cncc1Br
InChIInChI=1S/C7H7BrClN/c1-2-5-6(8)3-10-4-7(5)9/h3-4H,2H2,1H3
InChIKeyOLCPJMYCYQNZCT-UHFFFAOYSA-N
XLogP3.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.50
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-4-ethylpyridine?
The IUPAC name of 3-bromo-5-chloro-4-ethylpyridine (CID 148785357) is 3-bromo-5-chloro-4-ethylpyridine.
What is the SMILES notation for 3-bromo-5-chloro-4-ethylpyridine?
The canonical SMILES for 3-bromo-5-chloro-4-ethylpyridine is CCc1c(Cl)cncc1Br.
What is the InChIKey of 3-bromo-5-chloro-4-ethylpyridine?
The InChIKey is OLCPJMYCYQNZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrClN/c1-2-5-6(8)3-10-4-7(5)9/h3-4H,2H2,1H3.
What are the key properties of 3-bromo-5-chloro-4-ethylpyridine?
3-bromo-5-chloro-4-ethylpyridine has a molecular weight of 220.50 g/mol, XLogP of 3.06, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-4-ethylpyridine is sourced from PubChem (CID 148785357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).