N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

C15H11ClN2O4 — CID 6619078

IUPACN-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C15H11ClN2O4/c1-20-12-5-4-9(16)7-10(12)17-15(19)11-8-14(22-18-11)13-3-2-6-21-13/h2-8H,1H3,(H,17,19)
InChIKeyOQLQOOODSKNOSG-UHFFFAOYSA-N
MW318.72 g/mol
LogP3.85
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 6619078) has the molecular formula C15H11ClN2O4 and a molecular weight of 318.72 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID6619078
Molecular FormulaC15H11ClN2O4
Molecular Weight318.72 g/mol
Exact Mass318.04
IUPAC NameN-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C15H11ClN2O4/c1-20-12-5-4-9(16)7-10(12)17-15(19)11-8-14(22-18-11)13-3-2-6-21-13/h2-8H,1H3,(H,17,19)
InChIKeyOQLQOOODSKNOSG-UHFFFAOYSA-N
XLogP3.85
TPSA77.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.72
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 6619078) is N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1cc(-c2ccco2)on1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is OQLQOOODSKNOSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O4/c1-20-12-5-4-9(16)7-10(12)17-15(19)11-8-14(22-18-11)13-3-2-6-21-13/h2-8H,1H3,(H,17,19).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 318.72 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 6619078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).