N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide

C29H26N2O5 — CID 42785279

About N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide

N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide (PubChem CID 42785279) has the molecular formula C29H26N2O5 and a molecular weight of 482.54 g/mol. Its IUPAC name is N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide.

Molecular Properties

• Compound Name: N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
• PubChem CID: 42785279
• Molecular Formula: C29H26N2O5
• Molecular Weight: 482.54 g/mol
• Exact Mass: 482.18
• IUPAC Name: N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
• SMILES: COc1cccc(C(=O)N2CCc3oc(-c4cccc(NC(=O)COc5ccccc5)c4)cc3C2)c1
• InChI: InChI=1S/C29H26N2O5/c1-34-25-12-6-8-21(16-25)29(33)31-14-13-26-22(18-31)17-27(36-26)20-7-5-9-23(15-20)30-28(32)19-35-24-10-3-2-4-11-24/h2-12,15-17H,13-14,18-19H2,1H3,(H,30,32)
• InChIKey: LBYPAEITSRYDST-UHFFFAOYSA-N
• XLogP: 5.17
• TPSA: 81.01 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	482.54
LogP ≤ 5	5.17
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide?

The IUPAC name of N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide (CID 42785279) is N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide.

What is the SMILES notation for N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide?

The canonical SMILES for N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide is COc1cccc(C(=O)N2CCc3oc(-c4cccc(NC(=O)COc5ccccc5)c4)cc3C2)c1.

What is the InChIKey of N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide?

The InChIKey is LBYPAEITSRYDST-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2O5/c1-34-25-12-6-8-21(16-25)29(33)31-14-13-26-22(18-31)17-27(36-26)20-7-5-9-23(15-20)30-28(32)19-35-24-10-3-2-4-11-24/h2-12,15-17H,13-14,18-19H2,1H3,(H,30,32).

What are the key properties of N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide?

N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide has a molecular weight of 482.54 g/mol, XLogP of 5.17, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 42785279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).