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

C24H21N3O2 — CID 24801392

IUPAC6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2cnc(CCCc3ccc(-c4ccccc4)cc3)o2)nc1
InChIInChI=1S/C24H21N3O2/c25-24(28)20-13-14-21(26-15-20)22-16-27-23(29-22)8-4-5-17-9-11-19(12-10-17)18-6-2-1-3-7-18/h1-3,6-7,9-16H,4-5,8H2,(H2,25,28)
InChIKeyDFDJBNNGJXQWLO-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.68
Rot. Bonds7

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

6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide (PubChem CID 24801392) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
PubChem CID24801392
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2cnc(CCCc3ccc(-c4ccccc4)cc3)o2)nc1
InChIInChI=1S/C24H21N3O2/c25-24(28)20-13-14-21(26-15-20)22-16-27-23(29-22)8-4-5-17-9-11-19(12-10-17)18-6-2-1-3-7-18/h1-3,6-7,9-16H,4-5,8H2,(H2,25,28)
InChIKeyDFDJBNNGJXQWLO-UHFFFAOYSA-N
XLogP4.68
TPSA82.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The IUPAC name of 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide (CID 24801392) is 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide is NC(=O)c1ccc(-c2cnc(CCCc3ccc(-c4ccccc4)cc3)o2)nc1.
What is the InChIKey of 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
The InChIKey is DFDJBNNGJXQWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c25-24(28)20-13-14-21(26-15-20)22-16-27-23(29-22)8-4-5-17-9-11-19(12-10-17)18-6-2-1-3-7-18/h1-3,6-7,9-16H,4-5,8H2,(H2,25,28).
What are the key properties of 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide?
6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 4.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[3-(4-phenylphenyl)propyl]-1,3-oxazol-5-yl]pyridine-3-carboxamide is sourced from PubChem (CID 24801392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).