4-chloro-2-(4-ethoxyphenyl)pyridine

C13H12ClNO — CID 102825071

IUPAC4-chloro-2-(4-ethoxyphenyl)pyridine
SMILESCCOc1ccc(-c2cc(Cl)ccn2)cc1
InChIInChI=1S/C13H12ClNO/c1-2-16-12-5-3-10(4-6-12)13-9-11(14)7-8-15-13/h3-9H,2H2,1H3
InChIKeyDHABIFLRICXHFK-UHFFFAOYSA-N
MW233.70 g/mol
LogP3.80
Rot. Bonds3

About 4-chloro-2-(4-ethoxyphenyl)pyridine

4-chloro-2-(4-ethoxyphenyl)pyridine (PubChem CID 102825071) has the molecular formula C13H12ClNO and a molecular weight of 233.70 g/mol. Its IUPAC name is 4-chloro-2-(4-ethoxyphenyl)pyridine.

Molecular Properties

Compound Name4-chloro-2-(4-ethoxyphenyl)pyridine
PubChem CID102825071
Molecular FormulaC13H12ClNO
Molecular Weight233.70 g/mol
Exact Mass233.06
IUPAC Name4-chloro-2-(4-ethoxyphenyl)pyridine
SMILESCCOc1ccc(-c2cc(Cl)ccn2)cc1
InChIInChI=1S/C13H12ClNO/c1-2-16-12-5-3-10(4-6-12)13-9-11(14)7-8-15-13/h3-9H,2H2,1H3
InChIKeyDHABIFLRICXHFK-UHFFFAOYSA-N
XLogP3.80
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethoxyphenyl)-4-fluoropyridine
CID 102824424
2-(4-ethoxyphenyl)pyridine-4-carboxylic acid
CID 50999400
[4-(4-chloro-2-pyridinyl)phenyl] carbamate
CID 175565637
4-chloro-2-(2-ethoxyphenyl)pyridine
CID 102825098
4-(4-ethoxyphenyl)-2-methoxypyrimidine
CID 116903760
N-(4-chloro-2-pyridinyl)-4-ethoxybenzamide
CID 115626710
4-chloro-6-(4-ethoxyphenyl)-2-propylpyrimidine
CID 80945258
[4-(4-ethoxyphenyl)pyrimidin-2-yl]methanethiol
CID 116900346
6-chloro-2-(4-ethoxyphenyl)imidazo[1,2-a]pyridin-8-amine
CID 82059426
2-chloro-5-(4-ethoxyphenyl)pyridine
CID 19765548
2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole
CID 866005
1-(4-chlorophenyl)-3-(4-ethoxyphenyl)benzo[f]quinoline;hydrochloride
CID 90485158

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-ethoxyphenyl)pyridine?
The IUPAC name of 4-chloro-2-(4-ethoxyphenyl)pyridine (CID 102825071) is 4-chloro-2-(4-ethoxyphenyl)pyridine.
What is the SMILES notation for 4-chloro-2-(4-ethoxyphenyl)pyridine?
The canonical SMILES for 4-chloro-2-(4-ethoxyphenyl)pyridine is CCOc1ccc(-c2cc(Cl)ccn2)cc1.
What is the InChIKey of 4-chloro-2-(4-ethoxyphenyl)pyridine?
The InChIKey is DHABIFLRICXHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO/c1-2-16-12-5-3-10(4-6-12)13-9-11(14)7-8-15-13/h3-9H,2H2,1H3.
What are the key properties of 4-chloro-2-(4-ethoxyphenyl)pyridine?
4-chloro-2-(4-ethoxyphenyl)pyridine has a molecular weight of 233.70 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-ethoxyphenyl)pyridine is sourced from PubChem (CID 102825071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).