2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide

C23H19N3O3 — CID 2976148

IUPAC2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C23H19N3O3/c1-16(28-20-10-6-3-7-11-20)21(27)24-19-14-12-18(13-15-19)23-26-25-22(29-23)17-8-4-2-5-9-17/h2-16H,1H3,(H,24,27)
InChIKeyBUHCEFHKUMRUQN-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.81
Rot. Bonds6

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

2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide (PubChem CID 2976148) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
PubChem CID2976148
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC Name2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C23H19N3O3/c1-16(28-20-10-6-3-7-11-20)21(27)24-19-14-12-18(13-15-19)23-26-25-22(29-23)17-8-4-2-5-9-17/h2-16H,1H3,(H,24,27)
InChIKeyBUHCEFHKUMRUQN-UHFFFAOYSA-N
XLogP4.81
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide?
The IUPAC name of 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide (CID 2976148) is 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide.
What is the SMILES notation for 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide?
The canonical SMILES for 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide is CC(Oc1ccccc1)C(=O)Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1.
What is the InChIKey of 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide?
The InChIKey is BUHCEFHKUMRUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-16(28-20-10-6-3-7-11-20)21(27)24-19-14-12-18(13-15-19)23-26-25-22(29-23)17-8-4-2-5-9-17/h2-16H,1H3,(H,24,27).
What are the key properties of 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide?
2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide has a molecular weight of 385.42 g/mol, XLogP of 4.81, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide is sourced from PubChem (CID 2976148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).