N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide

C24H33N3O3 — CID 55779464

About N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide

N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide (PubChem CID 55779464) has the molecular formula C24H33N3O3 and a molecular weight of 411.55 g/mol. Its IUPAC name is N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide.

Molecular Properties

• Compound Name: N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide
• PubChem CID: 55779464
• Molecular Formula: C24H33N3O3
• Molecular Weight: 411.55 g/mol
• Exact Mass: 411.25
• IUPAC Name: N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide
• SMILES: Cc1ccc(C(C)C)cc1OC(C)C(=O)NCc1ccc(N2CCOC(C)C2)nc1
• InChI: InChI=1S/C24H33N3O3/c1-16(2)21-8-6-17(3)22(12-21)30-19(5)24(28)26-14-20-7-9-23(25-13-20)27-10-11-29-18(4)15-27/h6-9,12-13,16,18-19H,10-11,14-15H2,1-5H3,(H,26,28)
• InChIKey: FFIHZWCTFZOXTR-UHFFFAOYSA-N
• XLogP: 3.82
• TPSA: 63.69 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	411.55
LogP ≤ 5	3.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide?

The IUPAC name of N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide (CID 55779464) is N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide.

What is the SMILES notation for N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide?

The canonical SMILES for N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide is Cc1ccc(C(C)C)cc1OC(C)C(=O)NCc1ccc(N2CCOC(C)C2)nc1.

What is the InChIKey of N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide?

The InChIKey is FFIHZWCTFZOXTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O3/c1-16(2)21-8-6-17(3)22(12-21)30-19(5)24(28)26-14-20-7-9-23(25-13-20)27-10-11-29-18(4)15-27/h6-9,12-13,16,18-19H,10-11,14-15H2,1-5H3,(H,26,28).

What are the key properties of N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide?

N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide has a molecular weight of 411.55 g/mol, XLogP of 3.82, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 55779464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).