N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

C27H32N2O4 — CID 55801298

About N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (PubChem CID 55801298) has the molecular formula C27H32N2O4 and a molecular weight of 448.56 g/mol. Its IUPAC name is N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.

Molecular Properties

• Compound Name: N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
• PubChem CID: 55801298
• Molecular Formula: C27H32N2O4
• Molecular Weight: 448.56 g/mol
• Exact Mass: 448.24
• IUPAC Name: N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
• SMILES: CC1CN(Cc2ccccc2NC(=O)COc2ccc3oc4c(c3c2)CCCC4)CC(C)O1
• InChI: InChI=1S/C27H32N2O4/c1-18-14-29(15-19(2)32-18)16-20-7-3-5-9-24(20)28-27(30)17-31-21-11-12-26-23(13-21)22-8-4-6-10-25(22)33-26/h3,5,7,9,11-13,18-19H,4,6,8,10,14-17H2,1-2H3,(H,28,30)
• InChIKey: NIRBGRYXOMJDQQ-UHFFFAOYSA-N
• XLogP: 4.94
• TPSA: 63.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	448.56
LogP ≤ 5	4.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?

The IUPAC name of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (CID 55801298) is N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.

What is the SMILES notation for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?

The canonical SMILES for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is CC1CN(Cc2ccccc2NC(=O)COc2ccc3oc4c(c3c2)CCCC4)CC(C)O1.

What is the InChIKey of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?

The InChIKey is NIRBGRYXOMJDQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N2O4/c1-18-14-29(15-19(2)32-18)16-20-7-3-5-9-24(20)28-27(30)17-31-21-11-12-26-23(13-21)22-8-4-6-10-25(22)33-26/h3,5,7,9,11-13,18-19H,4,6,8,10,14-17H2,1-2H3,(H,28,30).

What are the key properties of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?

N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide has a molecular weight of 448.56 g/mol, XLogP of 4.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is sourced from PubChem (CID 55801298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).