6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine

C20H17Cl2NO — CID 15022699

IUPAC6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine
SMILESCCOc1cc(-c2cccc(Cl)c2)nc(-c2ccc(Cl)cc2)c1C
InChIInChI=1S/C20H17Cl2NO/c1-3-24-19-12-18(15-5-4-6-17(22)11-15)23-20(13(19)2)14-7-9-16(21)10-8-14/h4-12H,3H2,1-2H3
InChIKeyBSGNQOJJXZAUNI-UHFFFAOYSA-N
MW358.27 g/mol
LogP6.43
Rot. Bonds4

About 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine

6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine (PubChem CID 15022699) has the molecular formula C20H17Cl2NO and a molecular weight of 358.27 g/mol. Its IUPAC name is 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine.

Molecular Properties

Compound Name6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine
PubChem CID15022699
Molecular FormulaC20H17Cl2NO
Molecular Weight358.27 g/mol
Exact Mass357.07
IUPAC Name6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine
SMILESCCOc1cc(-c2cccc(Cl)c2)nc(-c2ccc(Cl)cc2)c1C
InChIInChI=1S/C20H17Cl2NO/c1-3-24-19-12-18(15-5-4-6-17(22)11-15)23-20(13(19)2)14-7-9-16(21)10-8-14/h4-12H,3H2,1-2H3
InChIKeyBSGNQOJJXZAUNI-UHFFFAOYSA-N
XLogP6.43
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.27
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-4-ethoxy-3-methyl-6-phenylpyridine
CID 15022696
2-(3-chlorophenyl)-4-ethoxy-3-methyl-6-thiophen-3-ylpyridine
CID 15754465
2-(4-chlorophenyl)-4-ethoxyquinoline
CID 10880586
2-(3-chlorophenyl)-5-ethoxypyridine-4-carbonitrile
CID 132588920
1-[2-(3-chlorophenyl)-4-ethoxyquinolin-6-yl]-3-(3-fluoro-4-methylphenyl)urea
CID 46385124
4-(3-chlorophenyl)-2-ethoxy-6-(3-methoxyphenyl)pyridine-3-carbonitrile
CID 4096252
methyl 6-(4-chlorophenyl)-4-ethoxy-2-ethylpyridine-3-carboxylate
CID 59487416
[2-(3-chlorophenyl)-4-ethoxyquinolin-6-yl]-piperidin-1-ylmethanone
CID 46318969
4-(3-chlorophenyl)-2-ethyl-5-methyl-1H-pyrimidin-6-one
CID 136692221
4-(3-bromophenyl)-6-(4-chlorophenyl)-2-ethoxypyridine-3-carbonitrile
CID 4266918
ethyl 3-(3-bromophenyl)-5-(3-chlorophenyl)pyrazine-2-carboxylate
CID 122223726
2-(3-chlorophenyl)-6-methoxypyridin-4-amine
CID 105495492

Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine?
The IUPAC name of 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine (CID 15022699) is 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine.
What is the SMILES notation for 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine?
The canonical SMILES for 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine is CCOc1cc(-c2cccc(Cl)c2)nc(-c2ccc(Cl)cc2)c1C.
What is the InChIKey of 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine?
The InChIKey is BSGNQOJJXZAUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17Cl2NO/c1-3-24-19-12-18(15-5-4-6-17(22)11-15)23-20(13(19)2)14-7-9-16(21)10-8-14/h4-12H,3H2,1-2H3.
What are the key properties of 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine?
6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine has a molecular weight of 358.27 g/mol, XLogP of 6.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenyl)-2-(4-chlorophenyl)-4-ethoxy-3-methylpyridine is sourced from PubChem (CID 15022699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).