8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine

C16H16N2 — CID 117147009

IUPAC8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine
SMILESCc1ccc(Cc2ncc3c(C)cccn23)cc1
InChIInChI=1S/C16H16N2/c1-12-5-7-14(8-6-12)10-16-17-11-15-13(2)4-3-9-18(15)16/h3-9,11H,10H2,1-2H3
InChIKeyNESARUCMDBJXLX-UHFFFAOYSA-N
MW236.32 g/mol
LogP3.54
Rot. Bonds2

About 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine

8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine (PubChem CID 117147009) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine
PubChem CID117147009
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine
SMILESCc1ccc(Cc2ncc3c(C)cccn23)cc1
InChIInChI=1S/C16H16N2/c1-12-5-7-14(8-6-12)10-16-17-11-15-13(2)4-3-9-18(15)16/h3-9,11H,10H2,1-2H3
InChIKeyNESARUCMDBJXLX-UHFFFAOYSA-N
XLogP3.54
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine?
The IUPAC name of 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine (CID 117147009) is 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine is Cc1ccc(Cc2ncc3c(C)cccn23)cc1.
What is the InChIKey of 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine?
The InChIKey is NESARUCMDBJXLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-12-5-7-14(8-6-12)10-16-17-11-15-13(2)4-3-9-18(15)16/h3-9,11H,10H2,1-2H3.
What are the key properties of 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine?
8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine has a molecular weight of 236.32 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-[(4-methylphenyl)methyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 117147009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).