2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide

C20H25N3O3S — CID 8693276

About 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide

2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide (PubChem CID 8693276) has the molecular formula C20H25N3O3S and a molecular weight of 387.51 g/mol. Its IUPAC name is 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
• PubChem CID: 8693276
• Molecular Formula: C20H25N3O3S
• Molecular Weight: 387.51 g/mol
• Exact Mass: 387.16
• IUPAC Name: 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
• SMILES: CN(CC(=O)N[C@@H](c1ccccc1)c1cccs1)CC(=O)N1CCOCC1
• InChI: InChI=1S/C20H25N3O3S/c1-22(15-19(25)23-9-11-26-12-10-23)14-18(24)21-20(17-8-5-13-27-17)16-6-3-2-4-7-16/h2-8,13,20H,9-12,14-15H2,1H3,(H,21,24)/t20-/m0/s1
• InChIKey: XXNYGXQAHPHIIU-FQEVSTJZSA-N
• XLogP: 1.74
• TPSA: 61.88 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	387.51
LogP ≤ 5	1.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?

The IUPAC name of 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide (CID 8693276) is 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide.

What is the SMILES notation for 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?

The canonical SMILES for 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide is CN(CC(=O)N[C@@H](c1ccccc1)c1cccs1)CC(=O)N1CCOCC1.

What is the InChIKey of 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?

The InChIKey is XXNYGXQAHPHIIU-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H25N3O3S/c1-22(15-19(25)23-9-11-26-12-10-23)14-18(24)21-20(17-8-5-13-27-17)16-6-3-2-4-7-16/h2-8,13,20H,9-12,14-15H2,1H3,(H,21,24)/t20-/m0/s1.

What are the key properties of 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?

2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide has a molecular weight of 387.51 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 8693276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).