N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide

C30H28N4O2 — CID 143000137

About N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide

N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide (PubChem CID 143000137) has the molecular formula C30H28N4O2 and a molecular weight of 476.58 g/mol. Its IUPAC name is N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide.

Molecular Properties

• Compound Name: N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide
• PubChem CID: 143000137
• Molecular Formula: C30H28N4O2
• Molecular Weight: 476.58 g/mol
• Exact Mass: 476.22
• IUPAC Name: N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide
• SMILES: O=Nc1ccc2c(c1)CCc1nc(NC(=O)Cc3ccc4ccccc4c3)c(C3CCCCC3)nc1-2
• InChI: InChI=1S/C30H28N4O2/c35-27(17-19-10-11-20-6-4-5-9-22(20)16-19)32-30-28(21-7-2-1-3-8-21)33-29-25-14-13-24(34-36)18-23(25)12-15-26(29)31-30/h4-6,9-11,13-14,16,18,21H,1-3,7-8,12,15,17H2,(H,31,32,35)
• InChIKey: SYXQRURLBYZVJK-UHFFFAOYSA-N
• XLogP: 7.02
• TPSA: 84.31 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	476.58
LogP ≤ 5	7.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide?

The IUPAC name of N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide (CID 143000137) is N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide.

What is the SMILES notation for N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide?

The canonical SMILES for N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide is O=Nc1ccc2c(c1)CCc1nc(NC(=O)Cc3ccc4ccccc4c3)c(C3CCCCC3)nc1-2.

What is the InChIKey of N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide?

The InChIKey is SYXQRURLBYZVJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N4O2/c35-27(17-19-10-11-20-6-4-5-9-22(20)16-19)32-30-28(21-7-2-1-3-8-21)33-29-25-14-13-24(34-36)18-23(25)12-15-26(29)31-30/h4-6,9-11,13-14,16,18,21H,1-3,7-8,12,15,17H2,(H,31,32,35).

What are the key properties of N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide?

N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide has a molecular weight of 476.58 g/mol, XLogP of 7.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-cyclohexyl-8-nitroso-5,6-dihydrobenzo[f]quinoxalin-3-yl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 143000137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).