2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine

C22H14ClN3 — CID 23025637

IUPAC2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine
SMILESClc1cccc(-c2nc3ncc(-c4cccc5ccccc45)cc3[nH]2)c1
InChIInChI=1S/C22H14ClN3/c23-17-8-3-7-15(11-17)21-25-20-12-16(13-24-22(20)26-21)19-10-4-6-14-5-1-2-9-18(14)19/h1-13H,(H,24,25,26)
InChIKeyKGWPRTBLOARSFL-UHFFFAOYSA-N
MW355.83 g/mol
LogP6.10
Rot. Bonds2

About 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine

2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine (PubChem CID 23025637) has the molecular formula C22H14ClN3 and a molecular weight of 355.83 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine
PubChem CID23025637
Molecular FormulaC22H14ClN3
Molecular Weight355.83 g/mol
Exact Mass355.09
IUPAC Name2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine
SMILESClc1cccc(-c2nc3ncc(-c4cccc5ccccc45)cc3[nH]2)c1
InChIInChI=1S/C22H14ClN3/c23-17-8-3-7-15(11-17)21-25-20-12-16(13-24-22(20)26-21)19-10-4-6-14-5-1-2-9-18(14)19/h1-13H,(H,24,25,26)
InChIKeyKGWPRTBLOARSFL-UHFFFAOYSA-N
XLogP6.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.83
LogP ≤ 56.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine (CID 23025637) is 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine is Clc1cccc(-c2nc3ncc(-c4cccc5ccccc45)cc3[nH]2)c1.
What is the InChIKey of 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine?
The InChIKey is KGWPRTBLOARSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14ClN3/c23-17-8-3-7-15(11-17)21-25-20-12-16(13-24-22(20)26-21)19-10-4-6-14-5-1-2-9-18(14)19/h1-13H,(H,24,25,26).
What are the key properties of 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine?
2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine has a molecular weight of 355.83 g/mol, XLogP of 6.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-6-naphthalen-1-yl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 23025637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).