3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide

C20H23N3O5 — CID 97260608

About 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide

3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide (PubChem CID 97260608) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide.

Molecular Properties

• Compound Name: 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide
• PubChem CID: 97260608
• Molecular Formula: C20H23N3O5
• Molecular Weight: 385.42 g/mol
• Exact Mass: 385.16
• IUPAC Name: 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide
• SMILES: COCC[C@@H](NC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)c1ccc(C)o1
• InChI: InChI=1S/C20H23N3O5/c1-13-7-8-17(28-13)15(10-12-27-2)21-18(24)9-11-23-16-6-4-3-5-14(16)19(25)22-20(23)26/h3-8,15H,9-12H2,1-2H3,(H,21,24)(H,22,25,26)/t15-/m1/s1
• InChIKey: WSQAJULURMRTQH-OAHLLOKOSA-N
• XLogP: 1.88
• TPSA: 106.33 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	385.42
LogP ≤ 5	1.88
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide?

The IUPAC name of 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide (CID 97260608) is 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide.

What is the SMILES notation for 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide?

The canonical SMILES for 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide is COCC[C@@H](NC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)c1ccc(C)o1.

What is the InChIKey of 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide?

The InChIKey is WSQAJULURMRTQH-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-13-7-8-17(28-13)15(10-12-27-2)21-18(24)9-11-23-16-6-4-3-5-14(16)19(25)22-20(23)26/h3-8,15H,9-12H2,1-2H3,(H,21,24)(H,22,25,26)/t15-/m1/s1.

What are the key properties of 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide?

3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide has a molecular weight of 385.42 g/mol, XLogP of 1.88, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(2,4-dioxoquinazolin-1-yl)-N-[(1R)-3-methoxy-1-(5-methylfuran-2-yl)propyl]propanamide is sourced from PubChem (CID 97260608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).