2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide

C24H21N3O5 — CID 32568690

IUPAC2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide
SMILESCCCN(Cc1nnc(-c2ccco2)o1)C(=O)COc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C24H21N3O5/c1-2-11-27(14-22-25-26-24(32-22)21-8-5-12-29-21)23(28)15-30-16-9-10-20-18(13-16)17-6-3-4-7-19(17)31-20/h3-10,12-13H,2,11,14-15H2,1H3
InChIKeyGICDEQMVIRGUPD-UHFFFAOYSA-N
MW431.45 g/mol
LogP5.05
Rot. Bonds8

About 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide

2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide (PubChem CID 32568690) has the molecular formula C24H21N3O5 and a molecular weight of 431.45 g/mol. Its IUPAC name is 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide.

Molecular Properties

Compound Name2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide
PubChem CID32568690
Molecular FormulaC24H21N3O5
Molecular Weight431.45 g/mol
Exact Mass431.15
IUPAC Name2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide
SMILESCCCN(Cc1nnc(-c2ccco2)o1)C(=O)COc1ccc2oc3ccccc3c2c1
InChIInChI=1S/C24H21N3O5/c1-2-11-27(14-22-25-26-24(32-22)21-8-5-12-29-21)23(28)15-30-16-9-10-20-18(13-16)17-6-3-4-7-19(17)31-20/h3-10,12-13H,2,11,14-15H2,1H3
InChIKeyGICDEQMVIRGUPD-UHFFFAOYSA-N
XLogP5.05
TPSA94.74 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.45
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide?
The IUPAC name of 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide (CID 32568690) is 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide.
What is the SMILES notation for 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide?
The canonical SMILES for 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide is CCCN(Cc1nnc(-c2ccco2)o1)C(=O)COc1ccc2oc3ccccc3c2c1.
What is the InChIKey of 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide?
The InChIKey is GICDEQMVIRGUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O5/c1-2-11-27(14-22-25-26-24(32-22)21-8-5-12-29-21)23(28)15-30-16-9-10-20-18(13-16)17-6-3-4-7-19(17)31-20/h3-10,12-13H,2,11,14-15H2,1H3.
What are the key properties of 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide?
2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide has a molecular weight of 431.45 g/mol, XLogP of 5.05, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yloxy-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylacetamide is sourced from PubChem (CID 32568690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).