2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one

C11H14N2O — CID 59580139

IUPAC2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one
SMILESCC(C)(C)c1cn2c(=O)cccc2[nH]1
InChIInChI=1S/C11H14N2O/c1-11(2,3)8-7-13-9(12-8)5-4-6-10(13)14/h4-7,12H,1-3H3
InChIKeyIVPBIHUCVMAVDV-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.93
Rot. Bonds

About 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one

2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one (PubChem CID 59580139) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one.

Molecular Properties

Compound Name2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one
PubChem CID59580139
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one
SMILESCC(C)(C)c1cn2c(=O)cccc2[nH]1
InChIInChI=1S/C11H14N2O/c1-11(2,3)8-7-13-9(12-8)5-4-6-10(13)14/h4-7,12H,1-3H3
InChIKeyIVPBIHUCVMAVDV-UHFFFAOYSA-N
XLogP1.93
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one?
The IUPAC name of 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one (CID 59580139) is 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one.
What is the SMILES notation for 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one?
The canonical SMILES for 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one is CC(C)(C)c1cn2c(=O)cccc2[nH]1.
What is the InChIKey of 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one?
The InChIKey is IVPBIHUCVMAVDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-11(2,3)8-7-13-9(12-8)5-4-6-10(13)14/h4-7,12H,1-3H3.
What are the key properties of 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one?
2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one has a molecular weight of 190.25 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1H-imidazo[1,2-a]pyridin-5-one is sourced from PubChem (CID 59580139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).