2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine

C22H19ClN2 — CID 46904304

IUPAC2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(Cc2c(-c3ccc(Cl)cc3)nc3cc(C)ccn23)cc1
InChIInChI=1S/C22H19ClN2/c1-15-3-5-17(6-4-15)14-20-22(18-7-9-19(23)10-8-18)24-21-13-16(2)11-12-25(20)21/h3-13H,14H2,1-2H3
InChIKeyZVLSDDQOXHTFOK-UHFFFAOYSA-N
MW346.86 g/mol
LogP5.86
Rot. Bonds3

About 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine

2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine (PubChem CID 46904304) has the molecular formula C22H19ClN2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine
PubChem CID46904304
Molecular FormulaC22H19ClN2
Molecular Weight346.86 g/mol
Exact Mass346.12
IUPAC Name2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(Cc2c(-c3ccc(Cl)cc3)nc3cc(C)ccn23)cc1
InChIInChI=1S/C22H19ClN2/c1-15-3-5-17(6-4-15)14-20-22(18-7-9-19(23)10-8-18)24-21-13-16(2)11-12-25(20)21/h3-13H,14H2,1-2H3
InChIKeyZVLSDDQOXHTFOK-UHFFFAOYSA-N
XLogP5.86
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.86
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine (CID 46904304) is 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine is Cc1ccc(Cc2c(-c3ccc(Cl)cc3)nc3cc(C)ccn23)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is ZVLSDDQOXHTFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN2/c1-15-3-5-17(6-4-15)14-20-22(18-7-9-19(23)10-8-18)24-21-13-16(2)11-12-25(20)21/h3-13H,14H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine?
2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 346.86 g/mol, XLogP of 5.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-7-methyl-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 46904304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).