2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine

C23H18ClN3 — CID 66829368

IUPAC2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine
SMILESClc1ccc(-c2ncccc2CC(c2cccnc2)c2cccnc2)cc1
InChIInChI=1S/C23H18ClN3/c24-21-9-7-17(8-10-21)23-18(4-3-13-27-23)14-22(19-5-1-11-25-15-19)20-6-2-12-26-16-20/h1-13,15-16,22H,14H2
InChIKeyABLHGAIGNXHAMD-UHFFFAOYSA-N
MW371.87 g/mol
LogP5.57
Rot. Bonds5

About 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine

2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine (PubChem CID 66829368) has the molecular formula C23H18ClN3 and a molecular weight of 371.87 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine
PubChem CID66829368
Molecular FormulaC23H18ClN3
Molecular Weight371.87 g/mol
Exact Mass371.12
IUPAC Name2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine
SMILESClc1ccc(-c2ncccc2CC(c2cccnc2)c2cccnc2)cc1
InChIInChI=1S/C23H18ClN3/c24-21-9-7-17(8-10-21)23-18(4-3-13-27-23)14-22(19-5-1-11-25-15-19)20-6-2-12-26-16-20/h1-13,15-16,22H,14H2
InChIKeyABLHGAIGNXHAMD-UHFFFAOYSA-N
XLogP5.57
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.87
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,2-dipyridin-3-ylethyl)-2-(4-methylphenyl)pyridine
CID 66829361
2-(cyclohexen-1-yl)-3-(2,2-dipyridin-3-ylethyl)pyridine
CID 66829358
3-(2,2-dipyridin-3-ylethyl)-2-(4-fluoro-2-methylphenyl)pyridine
CID 66829446
2-(2,4-dichlorophenyl)-3-(2-pyridin-3-ylpropyl)pyridine;methanamine
CID 143520386
2-(4-chlorophenyl)-3-(methoxymethyl)pyridine
CID 59165700
3-[1-chloro-2-(4-chlorophenyl)ethyl]pyridine
CID 63016477
3-(2,2-dipyridin-3-ylethyl)-N-ethyl-N-pyridin-3-ylpyridin-2-amine
CID 16662535
N-[3-(2,2-dipyridin-3-ylethyl)-2-pyridinyl]quinoxalin-6-amine
CID 16662857
3-(2,2-dipyridin-3-ylethyl)-N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 16662379
3-[2-[4-fluoro-2-(4-fluorophenyl)phenyl]-1-pyridin-3-ylethyl]pyridine
CID 67264973
2-(4-chlorophenyl)-3-fluoropyridine
CID 66678603
N-[3-(2,2-dipyridin-3-ylethyl)-2-pyridinyl]-2,6-dimethylpyrimidin-4-amine
CID 16662853

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine?
The IUPAC name of 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine (CID 66829368) is 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine?
The canonical SMILES for 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine is Clc1ccc(-c2ncccc2CC(c2cccnc2)c2cccnc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine?
The InChIKey is ABLHGAIGNXHAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18ClN3/c24-21-9-7-17(8-10-21)23-18(4-3-13-27-23)14-22(19-5-1-11-25-15-19)20-6-2-12-26-16-20/h1-13,15-16,22H,14H2.
What are the key properties of 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine?
2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine has a molecular weight of 371.87 g/mol, XLogP of 5.57, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(2,2-dipyridin-3-ylethyl)pyridine is sourced from PubChem (CID 66829368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).