N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide

C25H16FNO4 — CID 18860659

IUPACN-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1coc2ccc(F)cc12)Nc1c(C(=O)c2ccccc2)oc2ccccc12
InChIInChI=1S/C25H16FNO4/c26-17-10-11-20-19(13-17)16(14-30-20)12-22(28)27-23-18-8-4-5-9-21(18)31-25(23)24(29)15-6-2-1-3-7-15/h1-11,13-14H,12H2,(H,27,28)
InChIKeySDZIJRKBZNNUGU-UHFFFAOYSA-N
MW413.40 g/mol
LogP5.73
Rot. Bonds5

About N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide

N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide (PubChem CID 18860659) has the molecular formula C25H16FNO4 and a molecular weight of 413.40 g/mol. Its IUPAC name is N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
PubChem CID18860659
Molecular FormulaC25H16FNO4
Molecular Weight413.40 g/mol
Exact Mass413.11
IUPAC NameN-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1coc2ccc(F)cc12)Nc1c(C(=O)c2ccccc2)oc2ccccc12
InChIInChI=1S/C25H16FNO4/c26-17-10-11-20-19(13-17)16(14-30-20)12-22(28)27-23-18-8-4-5-9-21(18)31-25(23)24(29)15-6-2-1-3-7-15/h1-11,13-14H,12H2,(H,27,28)
InChIKeySDZIJRKBZNNUGU-UHFFFAOYSA-N
XLogP5.73
TPSA72.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.40
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-bromobenzoyl)-1-benzofuran-3-yl]-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860663
N-[2-(3-chloro-4-methoxybenzoyl)-1-benzofuran-3-yl]-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860701
2-(5-chloro-1-benzofuran-3-yl)-N-[2-(4-chlorobenzoyl)-1-benzofuran-3-yl]acetamide
CID 18860958
N-(2-benzoyl-1-benzofuran-3-yl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 18861651
2-(5-tert-butyl-1-benzofuran-3-yl)-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]acetamide
CID 18861282
2-(5-chloro-1-benzofuran-3-yl)-N-[2-(3-fluoro-4-methylbenzoyl)-1-benzofuran-3-yl]acetamide
CID 18861000
N-(2-benzoyl-1-benzofuran-3-yl)-2-(6,7-dimethyl-1-benzofuran-3-yl)acetamide
CID 18861596
3-[[2-(5-methyl-1-benzofuran-3-yl)acetyl]amino]-N-phenyl-1-benzofuran-2-carboxamide
CID 18861171
N-[2-(3-chloro-4-methoxybenzoyl)-1-benzofuran-3-yl]-2-(5-methoxy-1-benzofuran-3-yl)acetamide
CID 18860891
N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]-2-thiophen-3-ylacetamide
CID 139582398
N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860141
N-(2-benzoyl-1-benzofuran-3-yl)pentanamide
CID 3445962

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide (CID 18860659) is N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide is O=C(Cc1coc2ccc(F)cc12)Nc1c(C(=O)c2ccccc2)oc2ccccc12.
What is the InChIKey of N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The InChIKey is SDZIJRKBZNNUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16FNO4/c26-17-10-11-20-19(13-17)16(14-30-20)12-22(28)27-23-18-8-4-5-9-21(18)31-25(23)24(29)15-6-2-1-3-7-15/h1-11,13-14H,12H2,(H,27,28).
What are the key properties of N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide has a molecular weight of 413.40 g/mol, XLogP of 5.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 18860659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).