2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide

C9H7ClN2O3 — CID 13376511

IUPAC2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide
SMILESO=C(CCl)Nc1cc(-c2ccco2)on1
InChIInChI=1S/C9H7ClN2O3/c10-5-9(13)11-8-4-7(15-12-8)6-2-1-3-14-6/h1-4H,5H2,(H,11,12,13)
InChIKeyMGIUQKIDRGWJSW-UHFFFAOYSA-N
MW226.62 g/mol
LogP2.11
Rot. Bonds3

About 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide

2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide (PubChem CID 13376511) has the molecular formula C9H7ClN2O3 and a molecular weight of 226.62 g/mol. Its IUPAC name is 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide
PubChem CID13376511
Molecular FormulaC9H7ClN2O3
Molecular Weight226.62 g/mol
Exact Mass226.01
IUPAC Name2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide
SMILESO=C(CCl)Nc1cc(-c2ccco2)on1
InChIInChI=1S/C9H7ClN2O3/c10-5-9(13)11-8-4-7(15-12-8)6-2-1-3-14-6/h1-4H,5H2,(H,11,12,13)
InChIKeyMGIUQKIDRGWJSW-UHFFFAOYSA-N
XLogP2.11
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.62
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

5-(furan-2-yl)-1,2-oxazole-3-carbonyl chloride
CID 2795555
N-(3,4-dimethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 3244522
5-(furan-2-yl)-N-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide
CID 24739268
5-(furan-2-yl)-N-phenyl-1,2-oxazol-3-amine
CID 71761719
5-(furan-2-yl)-N-(2-methoxyethyl)-1,2-oxazole-3-carboxamide
CID 15995731
5-(furan-2-yl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-1,2-oxazole-3-carboxamide
CID 78927797
5-(furan-2-yl)-N-(3-iodophenyl)-1,2-oxazole-3-carboxamide
CID 24663749
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2,3-dimethylbutanamide
CID 118334208
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-(1,2-oxazol-3-yl)cyclopropane-1-carboxamide
CID 90502967
5-(furan-2-yl)-N-(2-methylsulfonylethyl)-1,2-oxazole-3-carboxamide
CID 110357164
5-(furan-2-yl)-N-[4-(sulfamoylmethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 24669152
N-(5-bromo-2-hydroxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 15995144

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide?
The IUPAC name of 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide (CID 13376511) is 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide.
What is the SMILES notation for 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide?
The canonical SMILES for 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide is O=C(CCl)Nc1cc(-c2ccco2)on1.
What is the InChIKey of 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide?
The InChIKey is MGIUQKIDRGWJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O3/c10-5-9(13)11-8-4-7(15-12-8)6-2-1-3-14-6/h1-4H,5H2,(H,11,12,13).
What are the key properties of 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide?
2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide has a molecular weight of 226.62 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[5-(furan-2-yl)-1,2-oxazol-3-yl]acetamide is sourced from PubChem (CID 13376511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).