6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide

C24H19N3O3 — CID 24799119

IUPAC6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2cnc(C(=O)CCc3ccc(-c4ccccc4)cc3)o2)nc1
InChIInChI=1S/C24H19N3O3/c25-23(29)19-11-12-20(26-14-19)22-15-27-24(30-22)21(28)13-8-16-6-9-18(10-7-16)17-4-2-1-3-5-17/h1-7,9-12,14-15H,8,13H2,(H2,25,29)
InChIKeyLWDPJRHTOVTKHC-UHFFFAOYSA-N
MW397.43 g/mol
LogP4.32
Rot. Bonds7

About 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide

6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide (PubChem CID 24799119) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
PubChem CID24799119
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC Name6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2cnc(C(=O)CCc3ccc(-c4ccccc4)cc3)o2)nc1
InChIInChI=1S/C24H19N3O3/c25-23(29)19-11-12-20(26-14-19)22-15-27-24(30-22)21(28)13-8-16-6-9-18(10-7-16)17-4-2-1-3-5-17/h1-7,9-12,14-15H,8,13H2,(H2,25,29)
InChIKeyLWDPJRHTOVTKHC-UHFFFAOYSA-N
XLogP4.32
TPSA99.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The IUPAC name of 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide (CID 24799119) is 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide is NC(=O)c1ccc(-c2cnc(C(=O)CCc3ccc(-c4ccccc4)cc3)o2)nc1.
What is the InChIKey of 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The InChIKey is LWDPJRHTOVTKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c25-23(29)19-11-12-20(26-14-19)22-15-27-24(30-22)21(28)13-8-16-6-9-18(10-7-16)17-4-2-1-3-5-17/h1-7,9-12,14-15H,8,13H2,(H2,25,29).
What are the key properties of 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide has a molecular weight of 397.43 g/mol, XLogP of 4.32, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide is sourced from PubChem (CID 24799119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).