[5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)

C29H31N4O3Os — CID 142819289

About [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)

[5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+) (PubChem CID 142819289) has the molecular formula C29H31N4O3Os and a molecular weight of 673.82 g/mol. Its IUPAC name is [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+).

Molecular Properties

• Compound Name: [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)
• PubChem CID: 142819289
• Molecular Formula: C29H31N4O3Os
• Molecular Weight: 673.82 g/mol
• Exact Mass: 675.20
• IUPAC Name: [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)
• SMILES: [N-]=C1CCc2cc(-c3oc(C4CCN(C(=O)CN5CCOCC5)CC4)cc3-c3ccncc3)ccc21.[Os+]
• InChI: InChI=1S/C29H31N4O3.Os/c30-26-4-2-22-17-23(1-3-24(22)26)29-25(20-5-9-31-10-6-20)18-27(36-29)21-7-11-33(12-8-21)28(34)19-32-13-15-35-16-14-32;/h1,3,5-6,9-10,17-18,21H,2,4,7-8,11-16,19H2;/q-1;+1
• InChIKey: ZZVWTYFUALEYAW-UHFFFAOYSA-N
• XLogP: 4.35
• TPSA: 81.11 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	673.82
LogP ≤ 5	4.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)?

The IUPAC name of [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+) (CID 142819289) is [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+).

What is the SMILES notation for [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)?

The canonical SMILES for [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+) is [N-]=C1CCc2cc(-c3oc(C4CCN(C(=O)CN5CCOCC5)CC4)cc3-c3ccncc3)ccc21.[Os+].

What is the InChIKey of [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)?

The InChIKey is ZZVWTYFUALEYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H31N4O3.Os/c30-26-4-2-22-17-23(1-3-24(22)26)29-25(20-5-9-31-10-6-20)18-27(36-29)21-7-11-33(12-8-21)28(34)19-32-13-15-35-16-14-32;/h1,3,5-6,9-10,17-18,21H,2,4,7-8,11-16,19H2;/q-1;+1.

What are the key properties of [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+)?

[5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+) has a molecular weight of 673.82 g/mol, XLogP of 4.35, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for [5-[5-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-pyridin-4-ylfuran-2-yl]-2,3-dihydroinden-1-ylidene]azanide;osmium(1+) is sourced from PubChem (CID 142819289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).