4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide

C26H29ClN2O5 — CID 25402275

About 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide

4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (PubChem CID 25402275) has the molecular formula C26H29ClN2O5 and a molecular weight of 484.98 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.

Molecular Properties

• Compound Name: 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
• PubChem CID: 25402275
• Molecular Formula: C26H29ClN2O5
• Molecular Weight: 484.98 g/mol
• Exact Mass: 484.18
• IUPAC Name: 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
• SMILES: COc1cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)ccc1OCc1ccc(Cl)cc1
• InChI: InChI=1S/C26H29ClN2O5/c1-18-3-9-23(34-18)22(29-11-13-32-14-12-29)16-28-26(30)20-6-10-24(25(15-20)31-2)33-17-19-4-7-21(27)8-5-19/h3-10,15,22H,11-14,16-17H2,1-2H3,(H,28,30)/t22-/m1/s1
• InChIKey: JLKKYRFXJLPDKY-JOCHJYFZSA-N
• XLogP: 4.63
• TPSA: 73.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	484.98
LogP ≤ 5	4.63
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?

The IUPAC name of 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide (CID 25402275) is 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide.

What is the SMILES notation for 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?

The canonical SMILES for 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is COc1cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)ccc1OCc1ccc(Cl)cc1.

What is the InChIKey of 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?

The InChIKey is JLKKYRFXJLPDKY-JOCHJYFZSA-N. The full InChI is InChI=1S/C26H29ClN2O5/c1-18-3-9-23(34-18)22(29-11-13-32-14-12-29)16-28-26(30)20-6-10-24(25(15-20)31-2)33-17-19-4-7-21(27)8-5-19/h3-10,15,22H,11-14,16-17H2,1-2H3,(H,28,30)/t22-/m1/s1.

What are the key properties of 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide?

4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide has a molecular weight of 484.98 g/mol, XLogP of 4.63, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide is sourced from PubChem (CID 25402275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).