6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine

C19H21BrN2O — CID 51359980

IUPAC6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine
SMILESCCCc1nc2c(C)cc(Br)cn2c1Cc1ccccc1OC
InChIInChI=1S/C19H21BrN2O/c1-4-7-16-17(11-14-8-5-6-9-18(14)23-3)22-12-15(20)10-13(2)19(22)21-16/h5-6,8-10,12H,4,7,11H2,1-3H3
InChIKeyACXDFHDKFXZYBL-UHFFFAOYSA-N
MW373.29 g/mol
LogP4.96
Rot. Bonds5

About 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine

6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine (PubChem CID 51359980) has the molecular formula C19H21BrN2O and a molecular weight of 373.29 g/mol. Its IUPAC name is 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine
PubChem CID51359980
Molecular FormulaC19H21BrN2O
Molecular Weight373.29 g/mol
Exact Mass372.08
IUPAC Name6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine
SMILESCCCc1nc2c(C)cc(Br)cn2c1Cc1ccccc1OC
InChIInChI=1S/C19H21BrN2O/c1-4-7-16-17(11-14-8-5-6-9-18(14)23-3)22-12-15(20)10-13(2)19(22)21-16/h5-6,8-10,12H,4,7,11H2,1-3H3
InChIKeyACXDFHDKFXZYBL-UHFFFAOYSA-N
XLogP4.96
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.29
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine (CID 51359980) is 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine is CCCc1nc2c(C)cc(Br)cn2c1Cc1ccccc1OC.
What is the InChIKey of 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine?
The InChIKey is ACXDFHDKFXZYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21BrN2O/c1-4-7-16-17(11-14-8-5-6-9-18(14)23-3)22-12-15(20)10-13(2)19(22)21-16/h5-6,8-10,12H,4,7,11H2,1-3H3.
What are the key properties of 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine?
6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine has a molecular weight of 373.29 g/mol, XLogP of 4.96, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine is sourced from PubChem (CID 51359980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).