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

C26H26N2O4 — CID 42785121

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

N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide (PubChem CID 42785121) has the molecular formula C26H26N2O4 and a molecular weight of 430.50 g/mol. Its IUPAC name is N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide.

Molecular Properties

• Compound Name: N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
• PubChem CID: 42785121
• Molecular Formula: C26H26N2O4
• Molecular Weight: 430.50 g/mol
• Exact Mass: 430.19
• IUPAC Name: N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
• SMILES: O=C(COc1ccccc1)Nc1ccc(-c2cc3c(o2)CCN(C(=O)C2CCC2)C3)cc1
• InChI: InChI=1S/C26H26N2O4/c29-25(17-31-22-7-2-1-3-8-22)27-21-11-9-18(10-12-21)24-15-20-16-28(14-13-23(20)32-24)26(30)19-5-4-6-19/h1-3,7-12,15,19H,4-6,13-14,16-17H2,(H,27,29)
• InChIKey: PZHAKFJQLPGHRL-UHFFFAOYSA-N
• XLogP: 4.65
• TPSA: 71.78 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	430.50
LogP ≤ 5	4.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide (CID 42785121) is N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide.

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

The canonical SMILES for N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1ccc(-c2cc3c(o2)CCN(C(=O)C2CCC2)C3)cc1.

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

The InChIKey is PZHAKFJQLPGHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O4/c29-25(17-31-22-7-2-1-3-8-22)27-21-11-9-18(10-12-21)24-15-20-16-28(14-13-23(20)32-24)26(30)19-5-4-6-19/h1-3,7-12,15,19H,4-6,13-14,16-17H2,(H,27,29).

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

N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide has a molecular weight of 430.50 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 42785121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).