N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide

C22H17N3O2 — CID 5329356

IUPACN-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide
SMILESCC(=O)Nc1oc(-c2cncc(-c3ccccc3)c2)nc1-c1ccccc1
InChIInChI=1S/C22H17N3O2/c1-15(26)24-22-20(17-10-6-3-7-11-17)25-21(27-22)19-12-18(13-23-14-19)16-8-4-2-5-9-16/h2-14H,1H3,(H,24,26)
InChIKeyDZCYFVPWGUECSY-UHFFFAOYSA-N
MW355.40 g/mol
LogP5.03
Rot. Bonds4

About N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide

N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide (PubChem CID 5329356) has the molecular formula C22H17N3O2 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide
PubChem CID5329356
Molecular FormulaC22H17N3O2
Molecular Weight355.40 g/mol
Exact Mass355.13
IUPAC NameN-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide
SMILESCC(=O)Nc1oc(-c2cncc(-c3ccccc3)c2)nc1-c1ccccc1
InChIInChI=1S/C22H17N3O2/c1-15(26)24-22-20(17-10-6-3-7-11-17)25-21(27-22)19-12-18(13-23-14-19)16-8-4-2-5-9-16/h2-14H,1H3,(H,24,26)
InChIKeyDZCYFVPWGUECSY-UHFFFAOYSA-N
XLogP5.03
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.40
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide?
The IUPAC name of N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide (CID 5329356) is N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide.
What is the SMILES notation for N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide?
The canonical SMILES for N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide is CC(=O)Nc1oc(-c2cncc(-c3ccccc3)c2)nc1-c1ccccc1.
What is the InChIKey of N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide?
The InChIKey is DZCYFVPWGUECSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2/c1-15(26)24-22-20(17-10-6-3-7-11-17)25-21(27-22)19-12-18(13-23-14-19)16-8-4-2-5-9-16/h2-14H,1H3,(H,24,26).
What are the key properties of N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide?
N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide has a molecular weight of 355.40 g/mol, XLogP of 5.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-phenyl-2-(5-phenyl-3-pyridinyl)-1,3-oxazol-5-yl]acetamide is sourced from PubChem (CID 5329356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).