2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide

C24H25N5O3 — CID 155443934

IUPAC2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C34COC(C)(C3)C4)cn2cc1C(=O)Nc1cc2ccccn2n1
InChIInChI=1S/C24H25N5O3/c1-15(2)32-18-9-21-25-19(24-12-23(3,13-24)31-14-24)11-28(21)10-17(18)22(30)26-20-8-16-6-4-5-7-29(16)27-20/h4-11,15H,12-14H2,1-3H3,(H,26,27,30)
InChIKeyJLEHJRPPFPQIGS-UHFFFAOYSA-N
MW431.50 g/mol
LogP3.84
Rot. Bonds5

About 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide

2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 155443934) has the molecular formula C24H25N5O3 and a molecular weight of 431.50 g/mol. Its IUPAC name is 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID155443934
Molecular FormulaC24H25N5O3
Molecular Weight431.50 g/mol
Exact Mass431.20
IUPAC Name2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCC(C)Oc1cc2nc(C34COC(C)(C3)C4)cn2cc1C(=O)Nc1cc2ccccn2n1
InChIInChI=1S/C24H25N5O3/c1-15(2)32-18-9-21-25-19(24-12-23(3,13-24)31-14-24)11-28(21)10-17(18)22(30)26-20-8-16-6-4-5-7-29(16)27-20/h4-11,15H,12-14H2,1-3H3,(H,26,27,30)
InChIKeyJLEHJRPPFPQIGS-UHFFFAOYSA-N
XLogP3.84
TPSA82.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide (CID 155443934) is 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide is CC(C)Oc1cc2nc(C34COC(C)(C3)C4)cn2cc1C(=O)Nc1cc2ccccn2n1.
What is the InChIKey of 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is JLEHJRPPFPQIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O3/c1-15(2)32-18-9-21-25-19(24-12-23(3,13-24)31-14-24)11-28(21)10-17(18)22(30)26-20-8-16-6-4-5-7-29(16)27-20/h4-11,15H,12-14H2,1-3H3,(H,26,27,30).
What are the key properties of 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide?
2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 431.50 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)-7-propan-2-yloxy-N-pyrazolo[1,5-a]pyridin-2-ylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 155443934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).