5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide

C17H15N3O2 — CID 24738148

IUPAC5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1cccnc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C17H15N3O2/c21-17(19-10-8-13-5-4-9-18-12-13)15-11-16(22-20-15)14-6-2-1-3-7-14/h1-7,9,11-12H,8,10H2,(H,19,21)
InChIKeyVYAKKFNMUHNDRC-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.71
Rot. Bonds5

About 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide

5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide (PubChem CID 24738148) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide
PubChem CID24738148
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1cccnc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C17H15N3O2/c21-17(19-10-8-13-5-4-9-18-12-13)15-11-16(22-20-15)14-6-2-1-3-7-14/h1-7,9,11-12H,8,10H2,(H,19,21)
InChIKeyVYAKKFNMUHNDRC-UHFFFAOYSA-N
XLogP2.71
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-phenyl-N-[3-(pyridine-3-carbonylamino)propyl]-1,2-oxazole-3-carboxamide
CID 118877101
N-[2-(4-hydroxyphenyl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 24738150
2-phenyl-N-(2-pyridin-3-ylethyl)-1,3-thiazole-4-carboxamide
CID 46546339
5-(4-methylphenyl)-N-[3-oxo-3-(pyridin-3-ylmethylamino)propyl]-1,2-oxazole-3-carboxamide
CID 46141727
N-ethyl-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 170210039
N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 39444927
N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 55759258
N-[3-(3-fluorophenyl)propyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 91954603
N-[2-(dimethylamino)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 44602317
N-[3-(chloroamino)propyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 118906505
[5-(4-hydroxyphenyl)-1,2-oxazol-3-yl] N-(2-pyridin-3-ylethyl)carbamate
CID 136655993
5-phenyl-N-[3-[(4-phenylpyridine-2-carbonyl)amino]propyl]-1,2-oxazole-3-carboxamide
CID 118877021

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide (CID 24738148) is 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide is O=C(NCCc1cccnc1)c1cc(-c2ccccc2)on1.
What is the InChIKey of 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is VYAKKFNMUHNDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c21-17(19-10-8-13-5-4-9-18-12-13)15-11-16(22-20-15)14-6-2-1-3-7-14/h1-7,9,11-12H,8,10H2,(H,19,21).
What are the key properties of 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide?
5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-(2-pyridin-3-ylethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 24738148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).