2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide

C25H19NO3 — CID 8928316

IUPAC2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)N[C@H](c1ccccc1)c1ccco1
InChIInChI=1S/C25H19NO3/c27-23(26-25(22-11-6-14-28-22)18-8-2-1-3-9-18)15-19-16-29-21-13-12-17-7-4-5-10-20(17)24(19)21/h1-14,16,25H,15H2,(H,26,27)/t25-/m1/s1
InChIKeyCMGIEFKLRGVJJG-RUZDIDTESA-N
MW381.43 g/mol
LogP5.63
Rot. Bonds5

About 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide

2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide (PubChem CID 8928316) has the molecular formula C25H19NO3 and a molecular weight of 381.43 g/mol. Its IUPAC name is 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide.

Molecular Properties

Compound Name2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide
PubChem CID8928316
Molecular FormulaC25H19NO3
Molecular Weight381.43 g/mol
Exact Mass381.14
IUPAC Name2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)N[C@H](c1ccccc1)c1ccco1
InChIInChI=1S/C25H19NO3/c27-23(26-25(22-11-6-14-28-22)18-8-2-1-3-9-18)15-19-16-29-21-13-12-17-7-4-5-10-20(17)24(19)21/h1-14,16,25H,15H2,(H,26,27)/t25-/m1/s1
InChIKeyCMGIEFKLRGVJJG-RUZDIDTESA-N
XLogP5.63
TPSA55.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.43
LogP ≤ 55.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzo[e][1]benzofuran-1-yl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide
CID 9149455
2-benzo[e][1]benzofuran-1-yl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9149456
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-benzo[e][1]benzofuran-1-ylacetate
CID 2417416
2-benzo[e][1]benzofuran-1-yl-N-[1-(3,4-difluorophenyl)ethyl]acetamide
CID 18112615
N-[furan-2-yl(phenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 51217838
2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide
CID 829773
methyl (2R)-2-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]-4-methylpentanoate
CID 9113240
2-(3,4-dichlorophenyl)-N-[(R)-furan-2-yl(phenyl)methyl]acetamide
CID 8928200
3-chloro-N-[furan-2-yl(phenyl)methyl]propanamide
CID 60780331
2-benzo[e][1]benzofuran-1-yl-N-(2-phenylsulfanylphenyl)acetamide
CID 4728261
5-chloro-N-[furan-2-yl(phenyl)methyl]pentanamide
CID 60780335
2-benzo[e][1]benzofuran-1-yl-N-piperidin-1-ylacetamide
CID 9271571

Frequently Asked Questions

What is the IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide?
The IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide (CID 8928316) is 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide.
What is the SMILES notation for 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide?
The canonical SMILES for 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide is O=C(Cc1coc2ccc3ccccc3c12)N[C@H](c1ccccc1)c1ccco1.
What is the InChIKey of 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide?
The InChIKey is CMGIEFKLRGVJJG-RUZDIDTESA-N. The full InChI is InChI=1S/C25H19NO3/c27-23(26-25(22-11-6-14-28-22)18-8-2-1-3-9-18)15-19-16-29-21-13-12-17-7-4-5-10-20(17)24(19)21/h1-14,16,25H,15H2,(H,26,27)/t25-/m1/s1.
What are the key properties of 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide?
2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide has a molecular weight of 381.43 g/mol, XLogP of 5.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzo[e][1]benzofuran-1-yl-N-[(R)-furan-2-yl(phenyl)methyl]acetamide is sourced from PubChem (CID 8928316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).