3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide

C19H25N5O2 — CID 126767158

About 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide

3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide (PubChem CID 126767158) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide.

Molecular Properties

• Compound Name: 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide
• PubChem CID: 126767158
• Molecular Formula: C19H25N5O2
• Molecular Weight: 355.44 g/mol
• Exact Mass: 355.20
• IUPAC Name: 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide
• SMILES: CC(C)c1nnc2ccc(NC(=O)CCc3ncc(C(C)(C)C)o3)cn12
• InChI: InChI=1S/C19H25N5O2/c1-12(2)18-23-22-15-7-6-13(11-24(15)18)21-16(25)8-9-17-20-10-14(26-17)19(3,4)5/h6-7,10-12H,8-9H2,1-5H3,(H,21,25)
• InChIKey: AEYDIMGFAIICPK-UHFFFAOYSA-N
• XLogP: 3.71
• TPSA: 85.32 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.44
LogP ≤ 5	3.71
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide?

The IUPAC name of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide (CID 126767158) is 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide.

What is the SMILES notation for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide?

The canonical SMILES for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide is CC(C)c1nnc2ccc(NC(=O)CCc3ncc(C(C)(C)C)o3)cn12.

What is the InChIKey of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide?

The InChIKey is AEYDIMGFAIICPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-12(2)18-23-22-15-7-6-13(11-24(15)18)21-16(25)8-9-17-20-10-14(26-17)19(3,4)5/h6-7,10-12H,8-9H2,1-5H3,(H,21,25).

What are the key properties of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide?

3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide has a molecular weight of 355.44 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide is sourced from PubChem (CID 126767158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).