7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium

C23H29I3N5O3V — CID 158156695

About 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium

7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium (PubChem CID 158156695) has the molecular formula C23H29I3N5O3V and a molecular weight of 855.17 g/mol. Its IUPAC name is 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium.

Molecular Properties

• Compound Name: 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium
• PubChem CID: 158156695
• Molecular Formula: C23H29I3N5O3V
• Molecular Weight: 855.17 g/mol
• Exact Mass: 854.88
• IUPAC Name: 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium
• SMILES: CCC(c1ccc(OC)nc1)N1CCN(CCCc2ccc3c(n2)NC(=O)CC3)C1=O.I[V](I)I
• InChI: InChI=1S/C23H29N5O3.3HI.V/c1-3-19(17-8-11-21(31-2)24-15-17)28-14-13-27(23(28)30)12-4-5-18-9-6-16-7-10-20(29)26-22(16)25-18;;;;/h6,8-9,11,15,19H,3-5,7,10,12-14H2,1-2H3,(H,25,26,29);3*1H;/q;;;;+3/p-3
• InChIKey: FVTVJQOLUSRVCS-UHFFFAOYSA-K
• XLogP: 5.85
• TPSA: 87.66 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	855.17
LogP ≤ 5	5.85
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium?

The IUPAC name of 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium (CID 158156695) is 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium.

What is the SMILES notation for 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium?

The canonical SMILES for 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium is CCC(c1ccc(OC)nc1)N1CCN(CCCc2ccc3c(n2)NC(=O)CC3)C1=O.I[V](I)I.

What is the InChIKey of 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium?

The InChIKey is FVTVJQOLUSRVCS-UHFFFAOYSA-K. The full InChI is InChI=1S/C23H29N5O3.3HI.V/c1-3-19(17-8-11-21(31-2)24-15-17)28-14-13-27(23(28)30)12-4-5-18-9-6-16-7-10-20(29)26-22(16)25-18;;;;/h6,8-9,11,15,19H,3-5,7,10,12-14H2,1-2H3,(H,25,26,29);3*1H;/q;;;;+3/p-3.

What are the key properties of 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium?

7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium has a molecular weight of 855.17 g/mol, XLogP of 5.85, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[3-[3-[1-(6-methoxy-3-pyridinyl)propyl]-2-oxoimidazolidin-1-yl]propyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;triiodovanadium is sourced from PubChem (CID 158156695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).