3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one

C17H21N3O — CID 170129244

IUPAC3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one
SMILESC=C1CCC(c2cn3cccc(C(C)(C)C)c3n2)C(=O)N1
InChIInChI=1S/C17H21N3O/c1-11-7-8-12(16(21)18-11)14-10-20-9-5-6-13(15(20)19-14)17(2,3)4/h5-6,9-10,12H,1,7-8H2,2-4H3,(H,18,21)
InChIKeyBDOONULADQANJD-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.14
Rot. Bonds1

About 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one

3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one (PubChem CID 170129244) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one.

Molecular Properties

Compound Name3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one
PubChem CID170129244
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one
SMILESC=C1CCC(c2cn3cccc(C(C)(C)C)c3n2)C(=O)N1
InChIInChI=1S/C17H21N3O/c1-11-7-8-12(16(21)18-11)14-10-20-9-5-6-13(15(20)19-14)17(2,3)4/h5-6,9-10,12H,1,7-8H2,2-4H3,(H,18,21)
InChIKeyBDOONULADQANJD-UHFFFAOYSA-N
XLogP3.14
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one?
The IUPAC name of 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one (CID 170129244) is 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one.
What is the SMILES notation for 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one?
The canonical SMILES for 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one is C=C1CCC(c2cn3cccc(C(C)(C)C)c3n2)C(=O)N1.
What is the InChIKey of 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one?
The InChIKey is BDOONULADQANJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-11-7-8-12(16(21)18-11)14-10-20-9-5-6-13(15(20)19-14)17(2,3)4/h5-6,9-10,12H,1,7-8H2,2-4H3,(H,18,21).
What are the key properties of 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one?
3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one has a molecular weight of 283.38 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)-6-methylidenepiperidin-2-one is sourced from PubChem (CID 170129244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).