N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

C16H14N2O5 — CID 15998742

IUPACN-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccco3)on2)c(OC)c1
InChIInChI=1S/C16H14N2O5/c1-20-10-5-6-11(14(8-10)21-2)17-16(19)12-9-15(23-18-12)13-4-3-7-22-13/h3-9H,1-2H3,(H,17,19)
InChIKeyUOHRFMZDXFXHBS-UHFFFAOYSA-N
MW314.30 g/mol
LogP3.20
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 15998742) has the molecular formula C16H14N2O5 and a molecular weight of 314.30 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID15998742
Molecular FormulaC16H14N2O5
Molecular Weight314.30 g/mol
Exact Mass314.09
IUPAC NameN-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccco3)on2)c(OC)c1
InChIInChI=1S/C16H14N2O5/c1-20-10-5-6-11(14(8-10)21-2)17-16(19)12-9-15(23-18-12)13-4-3-7-22-13/h3-9H,1-2H3,(H,17,19)
InChIKeyUOHRFMZDXFXHBS-UHFFFAOYSA-N
XLogP3.20
TPSA86.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.30
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(furan-2-yl)-N-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 16188844
N-(3-chlorophenyl)-5-(2-furyl)-3-isoxazolecarboxamide
CID 17253048
N-(5-chloro-2-hydroxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 4445460
N-(3-acetylphenyl)-5-(2-furyl)-3-isoxazolecarboxamide
CID 17253055
5-(2-furyl)-N-isobutylisoxazole-3-carboxamide
CID 3236696
N-(2,4-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 3238209
4-{[5-(2-Furyl)isoxazol-3-yl]carbonyl}morpholine
CID 3239637
5-(furan-2-yl)-N-propyl-1,2-oxazole-3-carboxamide
CID 3240242
N-(3,4-dimethylphenyl)-5-(2-furanyl)-3-isoxazolecarboxamide
CID 3244522
5-(furan-2-yl)-N-(2-phenylethyl)-1,2-oxazole-3-carboxamide
CID 3245765
N-(5-chloro-2-methoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 6619078
5-(2-furyl)-N-[2-(methylthio)phenyl]-3-isoxazolecarboxamide
CID 3640468

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 15998742) is N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is COc1ccc(NC(=O)c2cc(-c3ccco3)on2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is UOHRFMZDXFXHBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O5/c1-20-10-5-6-11(14(8-10)21-2)17-16(19)12-9-15(23-18-12)13-4-3-7-22-13/h3-9H,1-2H3,(H,17,19).
What are the key properties of N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 314.30 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 15998742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).