4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide

C18H18ClN3O — CID 59175651

IUPAC4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C18H18ClN3O/c1-18(2,3)13-6-4-12(5-7-13)17(23)21-15-11-22-10-14(19)8-9-16(22)20-15/h4-11H,1-3H3,(H,21,23)
InChIKeyGGUDNAJEGVAELQ-UHFFFAOYSA-N
MW327.82 g/mol
LogP4.54
Rot. Bonds2

About 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide

4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide (PubChem CID 59175651) has the molecular formula C18H18ClN3O and a molecular weight of 327.82 g/mol. Its IUPAC name is 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
PubChem CID59175651
Molecular FormulaC18H18ClN3O
Molecular Weight327.82 g/mol
Exact Mass327.11
IUPAC Name4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C18H18ClN3O/c1-18(2,3)13-6-4-12(5-7-13)17(23)21-15-11-22-10-14(19)8-9-16(22)20-15/h4-11H,1-3H3,(H,21,23)
InChIKeyGGUDNAJEGVAELQ-UHFFFAOYSA-N
XLogP4.54
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.82
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?
The IUPAC name of 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide (CID 59175651) is 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide.
What is the SMILES notation for 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?
The canonical SMILES for 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide is CC(C)(C)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1.
What is the InChIKey of 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?
The InChIKey is GGUDNAJEGVAELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O/c1-18(2,3)13-6-4-12(5-7-13)17(23)21-15-11-22-10-14(19)8-9-16(22)20-15/h4-11H,1-3H3,(H,21,23).
What are the key properties of 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?
4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide has a molecular weight of 327.82 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide is sourced from PubChem (CID 59175651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).