5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide

C14H10ClN3O3 — CID 3236895

IUPAC5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3cccc(Cl)c3)on2)no1
InChIInChI=1S/C14H10ClN3O3/c1-8-5-13(18-20-8)16-14(19)11-7-12(21-17-11)9-3-2-4-10(15)6-9/h2-7H,1H3,(H,16,18,19)
InChIKeyVRCVXGFLMTWPJV-UHFFFAOYSA-N
MW303.71 g/mol
LogP3.54
Rot. Bonds3

About 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide

5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide (PubChem CID 3236895) has the molecular formula C14H10ClN3O3 and a molecular weight of 303.71 g/mol. Its IUPAC name is 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide
PubChem CID3236895
Molecular FormulaC14H10ClN3O3
Molecular Weight303.71 g/mol
Exact Mass303.04
IUPAC Name5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3cccc(Cl)c3)on2)no1
InChIInChI=1S/C14H10ClN3O3/c1-8-5-13(18-20-8)16-14(19)11-7-12(21-17-11)9-3-2-4-10(15)6-9/h2-7H,1H3,(H,16,18,19)
InChIKeyVRCVXGFLMTWPJV-UHFFFAOYSA-N
XLogP3.54
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.71
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide (CID 3236895) is 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide is Cc1cc(NC(=O)c2cc(-c3cccc(Cl)c3)on2)no1.
What is the InChIKey of 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is VRCVXGFLMTWPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O3/c1-8-5-13(18-20-8)16-14(19)11-7-12(21-17-11)9-3-2-4-10(15)6-9/h2-7H,1H3,(H,16,18,19).
What are the key properties of 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide?
5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 303.71 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3236895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).