N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide

C19H19N3O3S — CID 52518637

IUPACN-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
SMILESC[C@H](Cc1ccsc1)NC(=O)CNC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C19H19N3O3S/c1-13(9-14-7-8-26-12-14)21-18(23)11-20-19(24)16-10-17(25-22-16)15-5-3-2-4-6-15/h2-8,10,12-13H,9,11H2,1H3,(H,20,24)(H,21,23)/t13-/m1/s1
InChIKeyHYNYUXLJCIFWCP-CYBMUJFWSA-N
MW369.45 g/mol
LogP2.88
Rot. Bonds7

About N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide

N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 52518637) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID52518637
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC NameN-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
SMILESC[C@H](Cc1ccsc1)NC(=O)CNC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C19H19N3O3S/c1-13(9-14-7-8-26-12-14)21-18(23)11-20-19(24)16-10-17(25-22-16)15-5-3-2-4-6-15/h2-8,10,12-13H,9,11H2,1H3,(H,20,24)(H,21,23)/t13-/m1/s1
InChIKeyHYNYUXLJCIFWCP-CYBMUJFWSA-N
XLogP2.88
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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N-[2-(methylamino)propyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 120827875
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N-pentan-2-yl-5-phenyl-1,2-oxazole-3-carboxamide
CID 133149969
N-[(2S)-2-hydroxy-2-thiophen-3-ylpropyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 96521382
N-[2-(2-ethylanilino)-2-oxoethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 51262131
N-(3-hydroxy-2-methylpropyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 65031495
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CID 99783279
N-[2-oxo-2-(pyridin-2-ylamino)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 51103315
2-(1-thiophen-3-ylpropan-2-ylcarbamoyl)benzoic acid
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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide (CID 52518637) is N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide is C[C@H](Cc1ccsc1)NC(=O)CNC(=O)c1cc(-c2ccccc2)on1.
What is the InChIKey of N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is HYNYUXLJCIFWCP-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H19N3O3S/c1-13(9-14-7-8-26-12-14)21-18(23)11-20-19(24)16-10-17(25-22-16)15-5-3-2-4-6-15/h2-8,10,12-13H,9,11H2,1H3,(H,20,24)(H,21,23)/t13-/m1/s1.
What are the key properties of N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide?
N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 369.45 g/mol, XLogP of 2.88, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[(2R)-1-thiophen-3-ylpropan-2-yl]amino]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 52518637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).