N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide

C20H23N5O4 — CID 24643797

About N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide (PubChem CID 24643797) has the molecular formula C20H23N5O4 and a molecular weight of 397.44 g/mol. Its IUPAC name is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide.

Molecular Properties

• Compound Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
• PubChem CID: 24643797
• Molecular Formula: C20H23N5O4
• Molecular Weight: 397.44 g/mol
• Exact Mass: 397.18
• IUPAC Name: N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
• SMILES: Cc1ccc(C(CNC(=O)Cn2nnc3ccccc3c2=O)N2CCOCC2)o1
• InChI: InChI=1S/C20H23N5O4/c1-14-6-7-18(29-14)17(24-8-10-28-11-9-24)12-21-19(26)13-25-20(27)15-4-2-3-5-16(15)22-23-25/h2-7,17H,8-13H2,1H3,(H,21,26)
• InChIKey: SQQUEYTWHWFAFT-UHFFFAOYSA-N
• XLogP: 0.88
• TPSA: 102.49 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	397.44
LogP ≤ 5	0.88
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?

The IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide (CID 24643797) is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide.

What is the SMILES notation for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?

The canonical SMILES for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide is Cc1ccc(C(CNC(=O)Cn2nnc3ccccc3c2=O)N2CCOCC2)o1.

What is the InChIKey of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?

The InChIKey is SQQUEYTWHWFAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O4/c1-14-6-7-18(29-14)17(24-8-10-28-11-9-24)12-21-19(26)13-25-20(27)15-4-2-3-5-16(15)22-23-25/h2-7,17H,8-13H2,1H3,(H,21,26).

What are the key properties of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide has a molecular weight of 397.44 g/mol, XLogP of 0.88, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide is sourced from PubChem (CID 24643797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).