3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide

C16H19N3O3 — CID 110633970

IUPAC3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCC(=O)NCCC(=O)NCCc1cc(-c2ccccc2)on1
InChIInChI=1S/C16H19N3O3/c1-12(20)17-10-8-16(21)18-9-7-14-11-15(22-19-14)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3,(H,17,20)(H,18,21)
InChIKeySAMKDUUQWZTEAL-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.53
Rot. Bonds7

About 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide

3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide (PubChem CID 110633970) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide
PubChem CID110633970
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCC(=O)NCCC(=O)NCCc1cc(-c2ccccc2)on1
InChIInChI=1S/C16H19N3O3/c1-12(20)17-10-8-16(21)18-9-7-14-11-15(22-19-14)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3,(H,17,20)(H,18,21)
InChIKeySAMKDUUQWZTEAL-UHFFFAOYSA-N
XLogP1.53
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-3-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]urea
CID 110314655
2-(4-fluorophenyl)-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]acetamide
CID 110314644
2-(2-methoxyphenoxy)-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]acetamide
CID 110314664
N-[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]ethyl]-3-phenoxypropanamide
CID 110314807
3-(5-phenyl-1,2-oxazol-3-yl)propanoic acid
CID 53414694
2-(5-phenyl-1,2-oxazol-3-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide
CID 110313138
N-[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]ethyl]-2-phenylacetamide
CID 110314800
N-[4-[2-(5-phenyl-1,2-oxazol-3-yl)ethylsulfamoyl]phenyl]acetamide
CID 110314714
2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide
CID 110312475
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-3-(furan-2-yl)propanamide
CID 110312504
N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]ethanesulfonamide
CID 110314681
1-[2-(4-hydroxyphenyl)ethyl]-3-[(5-phenyl-1,2-oxazol-3-yl)methyl]urea
CID 122156014

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide?
The IUPAC name of 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide (CID 110633970) is 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide is CC(=O)NCCC(=O)NCCc1cc(-c2ccccc2)on1.
What is the InChIKey of 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide?
The InChIKey is SAMKDUUQWZTEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-12(20)17-10-8-16(21)18-9-7-14-11-15(22-19-14)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide?
3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide has a molecular weight of 301.35 g/mol, XLogP of 1.53, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide is sourced from PubChem (CID 110633970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).