N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide

C26H19N3O3 — CID 1038406

IUPACN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide
SMILESO=C(Nc1ccc(-c2nnc(-c3ccco3)o2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H19N3O3/c30-24(23(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-21-15-13-20(14-16-21)25-28-29-26(32-25)22-12-7-17-31-22/h1-17,23H,(H,27,30)
InChIKeyMVNFAUPGPSNPTE-UHFFFAOYSA-N
MW421.46 g/mol
LogP5.77
Rot. Bonds6

About N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide

N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide (PubChem CID 1038406) has the molecular formula C26H19N3O3 and a molecular weight of 421.46 g/mol. Its IUPAC name is N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide
PubChem CID1038406
Molecular FormulaC26H19N3O3
Molecular Weight421.46 g/mol
Exact Mass421.14
IUPAC NameN-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide
SMILESO=C(Nc1ccc(-c2nnc(-c3ccco3)o2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H19N3O3/c30-24(23(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-21-15-13-20(14-16-21)25-28-29-26(32-25)22-12-7-17-31-22/h1-17,23H,(H,27,30)
InChIKeyMVNFAUPGPSNPTE-UHFFFAOYSA-N
XLogP5.77
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.46
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 815835
CID 815835
CID 1935420
CID 1935420
CID 661009
CID 661009
CID 44412436
CID 44412436
CID 1038405
CID 1038405
CID 1073872
CID 1073872
CID 1299651
CID 1299651
CID 1299744
CID 1299744
CID 2200770
CID 2200770
CID 691759
CID 691759
CID 738066
CID 738066
CID 644640
CID 644640

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide (CID 1038406) is N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide is O=C(Nc1ccc(-c2nnc(-c3ccco3)o2)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide?
The InChIKey is MVNFAUPGPSNPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N3O3/c30-24(23(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-21-15-13-20(14-16-21)25-28-29-26(32-25)22-12-7-17-31-22/h1-17,23H,(H,27,30).
What are the key properties of N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide?
N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide has a molecular weight of 421.46 g/mol, XLogP of 5.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 1038406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).