6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine

C16H16N2 — CID 172734332

IUPAC6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine
SMILESCc1ccc2cnc([C@H](C)c3ccccc3)n2c1
InChIInChI=1S/C16H16N2/c1-12-8-9-15-10-17-16(18(15)11-12)13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3/t13-/m1/s1
InChIKeyIFJRQBHKLKNMBE-CYBMUJFWSA-N
MW236.32 g/mol
LogP3.79
Rot. Bonds2

About 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine

6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine (PubChem CID 172734332) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine
PubChem CID172734332
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine
SMILESCc1ccc2cnc([C@H](C)c3ccccc3)n2c1
InChIInChI=1S/C16H16N2/c1-12-8-9-15-10-17-16(18(15)11-12)13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3/t13-/m1/s1
InChIKeyIFJRQBHKLKNMBE-CYBMUJFWSA-N
XLogP3.79
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 ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine?
The IUPAC name of 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine (CID 172734332) is 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine is Cc1ccc2cnc([C@H](C)c3ccccc3)n2c1.
What is the InChIKey of 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine?
The InChIKey is IFJRQBHKLKNMBE-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H16N2/c1-12-8-9-15-10-17-16(18(15)11-12)13(2)14-6-4-3-5-7-14/h3-11,13H,1-2H3/t13-/m1/s1.
What are the key properties of 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine?
6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine has a molecular weight of 236.32 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(1R)-1-phenylethyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 172734332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).