2-(1,3-oxazol-4-yl)-N-propylacetamide

C8H12N2O2 — CID 110686223

IUPAC2-(1,3-oxazol-4-yl)-N-propylacetamide
SMILESCCCNC(=O)Cc1cocn1
InChIInChI=1S/C8H12N2O2/c1-2-3-9-8(11)4-7-5-12-6-10-7/h5-6H,2-4H2,1H3,(H,9,11)
InChIKeyOVSDKEAADVTKSR-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.74
Rot. Bonds4

About 2-(1,3-oxazol-4-yl)-N-propylacetamide

2-(1,3-oxazol-4-yl)-N-propylacetamide (PubChem CID 110686223) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-(1,3-oxazol-4-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-(1,3-oxazol-4-yl)-N-propylacetamide
PubChem CID110686223
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name2-(1,3-oxazol-4-yl)-N-propylacetamide
SMILESCCCNC(=O)Cc1cocn1
InChIInChI=1S/C8H12N2O2/c1-2-3-9-8(11)4-7-5-12-6-10-7/h5-6H,2-4H2,1H3,(H,9,11)
InChIKeyOVSDKEAADVTKSR-UHFFFAOYSA-N
XLogP0.74
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686313
3-[[2-(1,3-oxazol-4-yl)acetyl]amino]propanoic acid
CID 83617873
4-[[2-(1,3-oxazol-4-yl)acetyl]amino]butanoic acid
CID 110836026
1-(1,3-oxazol-4-ylmethyl)-3-propylurea
CID 110747870
N-propyl-1,3-oxazole-4-carboxamide
CID 110689447
3-(1,3-oxazol-4-yl)-N-pentylpropanamide
CID 110679032
N-[(4-fluorophenyl)methyl]-2-(1,3-oxazol-4-yl)acetamide
CID 110686255
N-(5-chloro-2-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686353
2-(3-methoxyphenyl)-N-[2-(1,3-oxazol-4-yl)ethyl]acetamide
CID 110722006
N-(2,4-dimethylphenyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686330
2-(1,3-oxazol-4-yl)-N-(4-propan-2-yloxyphenyl)acetamide
CID 110686369
N-(4-cyanophenyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686437

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-oxazol-4-yl)-N-propylacetamide?
The IUPAC name of 2-(1,3-oxazol-4-yl)-N-propylacetamide (CID 110686223) is 2-(1,3-oxazol-4-yl)-N-propylacetamide.
What is the SMILES notation for 2-(1,3-oxazol-4-yl)-N-propylacetamide?
The canonical SMILES for 2-(1,3-oxazol-4-yl)-N-propylacetamide is CCCNC(=O)Cc1cocn1.
What is the InChIKey of 2-(1,3-oxazol-4-yl)-N-propylacetamide?
The InChIKey is OVSDKEAADVTKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-2-3-9-8(11)4-7-5-12-6-10-7/h5-6H,2-4H2,1H3,(H,9,11).
What are the key properties of 2-(1,3-oxazol-4-yl)-N-propylacetamide?
2-(1,3-oxazol-4-yl)-N-propylacetamide has a molecular weight of 168.20 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-oxazol-4-yl)-N-propylacetamide is sourced from PubChem (CID 110686223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).