8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine

C26H25N3O — CID 69095115

IUPAC8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine
SMILESCOc1ccccc1-c1cn2cccc(C3=CC(Cc4ccccc4)NCC3)c2n1
InChIInChI=1S/C26H25N3O/c1-30-25-12-6-5-10-23(25)24-18-29-15-7-11-22(26(29)28-24)20-13-14-27-21(17-20)16-19-8-3-2-4-9-19/h2-12,15,17-18,21,27H,13-14,16H2,1H3
InChIKeyQGCUHBRVMXJOKC-UHFFFAOYSA-N
MW395.51 g/mol
LogP5.00
Rot. Bonds5

About 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine

8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine (PubChem CID 69095115) has the molecular formula C26H25N3O and a molecular weight of 395.51 g/mol. Its IUPAC name is 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine
PubChem CID69095115
Molecular FormulaC26H25N3O
Molecular Weight395.51 g/mol
Exact Mass395.20
IUPAC Name8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine
SMILESCOc1ccccc1-c1cn2cccc(C3=CC(Cc4ccccc4)NCC3)c2n1
InChIInChI=1S/C26H25N3O/c1-30-25-12-6-5-10-23(25)24-18-29-15-7-11-22(26(29)28-24)20-13-14-27-21(17-20)16-19-8-3-2-4-9-19/h2-12,15,17-18,21,27H,13-14,16H2,1H3
InChIKeyQGCUHBRVMXJOKC-UHFFFAOYSA-N
XLogP5.00
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine (CID 69095115) is 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine is COc1ccccc1-c1cn2cccc(C3=CC(Cc4ccccc4)NCC3)c2n1.
What is the InChIKey of 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine?
The InChIKey is QGCUHBRVMXJOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O/c1-30-25-12-6-5-10-23(25)24-18-29-15-7-11-22(26(29)28-24)20-13-14-27-21(17-20)16-19-8-3-2-4-9-19/h2-12,15,17-18,21,27H,13-14,16H2,1H3.
What are the key properties of 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine?
8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine has a molecular weight of 395.51 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-2-(2-methoxyphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 69095115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).