2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide

C18H25N5O4 — CID 74797903

About 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide

2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide (PubChem CID 74797903) has the molecular formula C18H25N5O4 and a molecular weight of 375.43 g/mol. Its IUPAC name is 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide.

Molecular Properties

• Compound Name: 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide
• PubChem CID: 74797903
• Molecular Formula: C18H25N5O4
• Molecular Weight: 375.43 g/mol
• Exact Mass: 375.19
• IUPAC Name: 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide
• SMILES: CCOCC(=O)Nc1cc(-c2ccco2)nn1C1NC(=O)CC(C(C)C)N1
• InChI: InChI=1S/C18H25N5O4/c1-4-26-10-17(25)20-15-8-13(14-6-5-7-27-14)22-23(15)18-19-12(11(2)3)9-16(24)21-18/h5-8,11-12,18-19H,4,9-10H2,1-3H3,(H,20,25)(H,21,24)
• InChIKey: AGEJFXACVFUAGH-UHFFFAOYSA-N
• XLogP: 1.71
• TPSA: 110.42 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	375.43
LogP ≤ 5	1.71
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide?

The IUPAC name of 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide (CID 74797903) is 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide.

What is the SMILES notation for 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide?

The canonical SMILES for 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide is CCOCC(=O)Nc1cc(-c2ccco2)nn1C1NC(=O)CC(C(C)C)N1.

What is the InChIKey of 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide?

The InChIKey is AGEJFXACVFUAGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O4/c1-4-26-10-17(25)20-15-8-13(14-6-5-7-27-14)22-23(15)18-19-12(11(2)3)9-16(24)21-18/h5-8,11-12,18-19H,4,9-10H2,1-3H3,(H,20,25)(H,21,24).

What are the key properties of 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide?

2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide has a molecular weight of 375.43 g/mol, XLogP of 1.71, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethoxy-N-[3-(furan-2-yl)-1-(4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)pyrazol-5-yl]acetamide is sourced from PubChem (CID 74797903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).