6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide

C20H17N7O2 — CID 146408054

IUPAC6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4occn34)cn12
InChIInChI=1S/C20H17N7O2/c21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-11,13H,1-3H2,(H2,21,28)
InChIKeyLFJQAYQFHSIXQW-UHFFFAOYSA-N
MW387.40 g/mol
LogP2.93
Rot. Bonds4

About 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide

6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 146408054) has the molecular formula C20H17N7O2 and a molecular weight of 387.40 g/mol. Its IUPAC name is 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID146408054
Molecular FormulaC20H17N7O2
Molecular Weight387.40 g/mol
Exact Mass387.14
IUPAC Name6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESNC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4occn34)cn12
InChIInChI=1S/C20H17N7O2/c21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-11,13H,1-3H2,(H2,21,28)
InChIKeyLFJQAYQFHSIXQW-UHFFFAOYSA-N
XLogP2.93
TPSA108.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 146408054) is 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide is NC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4occn34)cn12.
What is the InChIKey of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LFJQAYQFHSIXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7O2/c21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-11,13H,1-3H2,(H2,21,28).
What are the key properties of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide?
6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 387.40 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]oxazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 146408054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).