3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide

C22H18N4O2 — CID 110320848

IUPAC3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
SMILESO=C(NCCc1nnc(-c2ccncc2)o1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C22H18N4O2/c27-21(19-8-4-7-18(15-19)16-5-2-1-3-6-16)24-14-11-20-25-26-22(28-20)17-9-12-23-13-10-17/h1-10,12-13,15H,11,14H2,(H,24,27)
InChIKeyOZQOMBIZRWXAPW-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.77
Rot. Bonds6

About 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide

3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide (PubChem CID 110320848) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
PubChem CID110320848
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC Name3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
SMILESO=C(NCCc1nnc(-c2ccncc2)o1)c1cccc(-c2ccccc2)c1
InChIInChI=1S/C22H18N4O2/c27-21(19-8-4-7-18(15-19)16-5-2-1-3-6-16)24-14-11-20-25-26-22(28-20)17-9-12-23-13-10-17/h1-10,12-13,15H,11,14H2,(H,24,27)
InChIKeyOZQOMBIZRWXAPW-UHFFFAOYSA-N
XLogP3.77
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-benzodioxole-5-carboxamide
CID 110320840
2-methyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 110320797
2,3-difluoro-N-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 146126861
N-[2-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]pyridine-4-carboxamide
CID 110321211
2,2-dimethyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
CID 110320792
N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]cyclopropanecarboxamide
CID 110320787
N-[2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]pyridine-3-carboxamide
CID 110321949
N-[2-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]-3-methylbenzamide
CID 110320940
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-4-phenylbenzamide
CID 110320276
N-[2-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]-3,4-dimethylbenzamide
CID 110321629
N-[2-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)ethyl]thiophene-2-carboxamide
CID 110320653
N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3-pyrazol-1-ylbenzamide
CID 50954392

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide?
The IUPAC name of 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide (CID 110320848) is 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide.
What is the SMILES notation for 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide?
The canonical SMILES for 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide is O=C(NCCc1nnc(-c2ccncc2)o1)c1cccc(-c2ccccc2)c1.
What is the InChIKey of 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide?
The InChIKey is OZQOMBIZRWXAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c27-21(19-8-4-7-18(15-19)16-5-2-1-3-6-16)24-14-11-20-25-26-22(28-20)17-9-12-23-13-10-17/h1-10,12-13,15H,11,14H2,(H,24,27).
What are the key properties of 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide?
3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide has a molecular weight of 370.41 g/mol, XLogP of 3.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-[2-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)ethyl]benzamide is sourced from PubChem (CID 110320848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).