N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide

C23H24N2O4 — CID 1467384

About N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide

N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide (PubChem CID 1467384) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide.

Molecular Properties

• Compound Name: N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide
• PubChem CID: 1467384
• Molecular Formula: C23H24N2O4
• Molecular Weight: 392.46 g/mol
• Exact Mass: 392.17
• IUPAC Name: N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide
• SMILES: CCC(=O)N(CCc1ccccc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3
• InChI: InChI=1S/C23H24N2O4/c1-2-22(26)25(9-8-16-6-4-3-5-7-16)15-18-12-17-13-20-21(29-11-10-28-20)14-19(17)24-23(18)27/h3-7,12-14H,2,8-11,15H2,1H3,(H,24,27)
• InChIKey: PFRJRVNZOYFGTM-UHFFFAOYSA-N
• XLogP: 3.28
• TPSA: 71.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	392.46
LogP ≤ 5	3.28
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide?

The IUPAC name of N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide (CID 1467384) is N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide.

What is the SMILES notation for N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide?

The canonical SMILES for N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide is CCC(=O)N(CCc1ccccc1)Cc1cc2cc3c(cc2[nH]c1=O)OCCO3.

What is the InChIKey of N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide?

The InChIKey is PFRJRVNZOYFGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-2-22(26)25(9-8-16-6-4-3-5-7-16)15-18-12-17-13-20-21(29-11-10-28-20)14-19(17)24-23(18)27/h3-7,12-14H,2,8-11,15H2,1H3,(H,24,27).

What are the key properties of N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide?

N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide has a molecular weight of 392.46 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 1467384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).