8-tert-butyl-3-methylimidazo[1,5-a]pyridine

C12H16N2 — CID 91043219

IUPAC8-tert-butyl-3-methylimidazo[1,5-a]pyridine
SMILESCc1ncc2c(C(C)(C)C)cccn12
InChIInChI=1S/C12H16N2/c1-9-13-8-11-10(12(2,3)4)6-5-7-14(9)11/h5-8H,1-4H3
InChIKeyCSOYPHLPFQIMLF-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.94
Rot. Bonds

About 8-tert-butyl-3-methylimidazo[1,5-a]pyridine

8-tert-butyl-3-methylimidazo[1,5-a]pyridine (PubChem CID 91043219) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 8-tert-butyl-3-methylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name8-tert-butyl-3-methylimidazo[1,5-a]pyridine
PubChem CID91043219
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name8-tert-butyl-3-methylimidazo[1,5-a]pyridine
SMILESCc1ncc2c(C(C)(C)C)cccn12
InChIInChI=1S/C12H16N2/c1-9-13-8-11-10(12(2,3)4)6-5-7-14(9)11/h5-8H,1-4H3
InChIKeyCSOYPHLPFQIMLF-UHFFFAOYSA-N
XLogP2.94
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-3-methylimidazo[1,5-a]pyridine
CID 117147086
6-tert-butyl-3-methylimidazo[1,5-a]pyridine
CID 122429271
8-tert-butylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 166563458
2-amino-3-(3-methylimidazo[1,5-a]pyridin-8-yl)propanoic acid
CID 83836982
1,4-ditert-butylpyrrolo[1,2-a]pyrazine
CID 171454856
ethyl 8-tert-butylimidazo[1,2-a]pyridine-3-carboxylate
CID 166563440
8-tert-butyl-N-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
CID 134186125
N-methyl-1-(8-methylimidazo[1,5-a]pyridin-3-yl)methanamine
CID 83865145
4-(8-methylimidazo[1,5-a]pyridin-3-yl)phenol
CID 137006648
2-(8-propan-2-ylsulfanylimidazo[1,5-a]pyridin-3-yl)propan-2-amine
CID 162356505
3-(2-bromophenyl)-8-methylimidazo[1,5-a]pyridine
CID 117147172
methyl 3,8-dimethylimidazo[1,5-a]pyridine-7-carboxylate
CID 59565193

Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-3-methylimidazo[1,5-a]pyridine?
The IUPAC name of 8-tert-butyl-3-methylimidazo[1,5-a]pyridine (CID 91043219) is 8-tert-butyl-3-methylimidazo[1,5-a]pyridine.
What is the SMILES notation for 8-tert-butyl-3-methylimidazo[1,5-a]pyridine?
The canonical SMILES for 8-tert-butyl-3-methylimidazo[1,5-a]pyridine is Cc1ncc2c(C(C)(C)C)cccn12.
What is the InChIKey of 8-tert-butyl-3-methylimidazo[1,5-a]pyridine?
The InChIKey is CSOYPHLPFQIMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-9-13-8-11-10(12(2,3)4)6-5-7-14(9)11/h5-8H,1-4H3.
What are the key properties of 8-tert-butyl-3-methylimidazo[1,5-a]pyridine?
8-tert-butyl-3-methylimidazo[1,5-a]pyridine has a molecular weight of 188.27 g/mol, XLogP of 2.94, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-3-methylimidazo[1,5-a]pyridine is sourced from PubChem (CID 91043219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).