2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine

C24H25N5O — CID 131671017

About 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine

2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine (PubChem CID 131671017) has the molecular formula C24H25N5O and a molecular weight of 399.50 g/mol. Its IUPAC name is 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine.

Molecular Properties

• Compound Name: 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine
• PubChem CID: 131671017
• Molecular Formula: C24H25N5O
• Molecular Weight: 399.50 g/mol
• Exact Mass: 399.21
• IUPAC Name: 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine
• SMILES: Cc1ccc(-c2ccc3c(C4CN(Cc5cccc(C)n5)CCO4)nnn3c2)cc1
• InChI: InChI=1S/C24H25N5O/c1-17-6-8-19(9-7-17)20-10-11-22-24(26-27-29(22)14-20)23-16-28(12-13-30-23)15-21-5-3-4-18(2)25-21/h3-11,14,23H,12-13,15-16H2,1-2H3
• InChIKey: HCJRLXOMINORPK-UHFFFAOYSA-N
• XLogP: 3.98
• TPSA: 55.55 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	399.50
LogP ≤ 5	3.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine?

The IUPAC name of 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine (CID 131671017) is 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine.

What is the SMILES notation for 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine?

The canonical SMILES for 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine is Cc1ccc(-c2ccc3c(C4CN(Cc5cccc(C)n5)CCO4)nnn3c2)cc1.

What is the InChIKey of 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine?

The InChIKey is HCJRLXOMINORPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O/c1-17-6-8-19(9-7-17)20-10-11-22-24(26-27-29(22)14-20)23-16-28(12-13-30-23)15-21-5-3-4-18(2)25-21/h3-11,14,23H,12-13,15-16H2,1-2H3.

What are the key properties of 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine?

2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine has a molecular weight of 399.50 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-[(6-methyl-2-pyridinyl)methyl]morpholine is sourced from PubChem (CID 131671017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).