N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide

C28H27NO3 — CID 19244117

About N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide

N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide (PubChem CID 19244117) has the molecular formula C28H27NO3 and a molecular weight of 425.53 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide.

Molecular Properties

• Compound Name: N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide
• PubChem CID: 19244117
• Molecular Formula: C28H27NO3
• Molecular Weight: 425.53 g/mol
• Exact Mass: 425.20
• IUPAC Name: N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide
• SMILES: CC1CC1c1ccc(CN(Cc2ccco2)C(=O)C(c2ccccc2)c2ccccc2)o1
• InChI: InChI=1S/C28H27NO3/c1-20-17-25(20)26-15-14-24(32-26)19-29(18-23-13-8-16-31-23)28(30)27(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-16,20,25,27H,17-19H2,1H3
• InChIKey: LHMHTDAPHQYQJL-UHFFFAOYSA-N
• XLogP: 6.36
• TPSA: 46.59 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 8
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	425.53
LogP ≤ 5	6.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide?

The IUPAC name of N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide (CID 19244117) is N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide.

What is the SMILES notation for N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide?

The canonical SMILES for N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide is CC1CC1c1ccc(CN(Cc2ccco2)C(=O)C(c2ccccc2)c2ccccc2)o1.

What is the InChIKey of N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide?

The InChIKey is LHMHTDAPHQYQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27NO3/c1-20-17-25(20)26-15-14-24(32-26)19-29(18-23-13-8-16-31-23)28(30)27(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-16,20,25,27H,17-19H2,1H3.

What are the key properties of N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide?

N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide has a molecular weight of 425.53 g/mol, XLogP of 6.36, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(furan-2-ylmethyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-2,2-diphenylacetamide is sourced from PubChem (CID 19244117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).