3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine

C12H16N2O — CID 146480145

IUPAC3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine
SMILESCOc1ccn2c(C(C)(C)C)cnc2c1
InChIInChI=1S/C12H16N2O/c1-12(2,3)10-8-13-11-7-9(15-4)5-6-14(10)11/h5-8H,1-4H3
InChIKeyWBLCSSBYJPTUSH-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.64
Rot. Bonds1

About 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine

3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine (PubChem CID 146480145) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine
PubChem CID146480145
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine
SMILESCOc1ccn2c(C(C)(C)C)cnc2c1
InChIInChI=1S/C12H16N2O/c1-12(2,3)10-8-13-11-7-9(15-4)5-6-14(10)11/h5-8H,1-4H3
InChIKeyWBLCSSBYJPTUSH-UHFFFAOYSA-N
XLogP2.64
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine?
The IUPAC name of 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine (CID 146480145) is 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine is COc1ccn2c(C(C)(C)C)cnc2c1.
What is the InChIKey of 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine?
The InChIKey is WBLCSSBYJPTUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-12(2,3)10-8-13-11-7-9(15-4)5-6-14(10)11/h5-8H,1-4H3.
What are the key properties of 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine?
3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine has a molecular weight of 204.27 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-7-methoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 146480145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).