2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

C23H23Cl2N3 — CID 156786922

About 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine

2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (PubChem CID 156786922) has the molecular formula C23H23Cl2N3 and a molecular weight of 412.36 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
• PubChem CID: 156786922
• Molecular Formula: C23H23Cl2N3
• Molecular Weight: 412.36 g/mol
• Exact Mass: 411.13
• IUPAC Name: 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
• SMILES: Cn1c(-c2ccccc2Cl)nc2c1CN(C1CCc3cccc(Cl)c3C1)CC2
• InChI: InChI=1S/C23H23Cl2N3/c1-27-22-14-28(16-10-9-15-5-4-8-20(25)18(15)13-16)12-11-21(22)26-23(27)17-6-2-3-7-19(17)24/h2-8,16H,9-14H2,1H3
• InChIKey: HRCBARKRTUJKLN-UHFFFAOYSA-N
• XLogP: 5.31
• TPSA: 21.06 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 2
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	412.36
LogP ≤ 5	5.31
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The IUPAC name of 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine (CID 156786922) is 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The canonical SMILES for 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is Cn1c(-c2ccccc2Cl)nc2c1CN(C1CCc3cccc(Cl)c3C1)CC2.

What is the InChIKey of 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

The InChIKey is HRCBARKRTUJKLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23Cl2N3/c1-27-22-14-28(16-10-9-15-5-4-8-20(25)18(15)13-16)12-11-21(22)26-23(27)17-6-2-3-7-19(17)24/h2-8,16H,9-14H2,1H3.

What are the key properties of 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine?

2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine has a molecular weight of 412.36 g/mol, XLogP of 5.31, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-chlorophenyl)-5-(8-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 156786922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).