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

C21H15ClN2O4 — CID 24578806

IUPAC5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cc(Cl)ccc1OCc1cc(-c2ccco2)on1
InChIInChI=1S/C21H15ClN2O4/c22-14-8-9-18(17(11-14)21(25)23-15-5-2-1-3-6-15)27-13-16-12-20(28-24-16)19-7-4-10-26-19/h1-12H,13H2,(H,23,25)
InChIKeyVFYFPGOKDZLMCH-UHFFFAOYSA-N
MW394.81 g/mol
LogP5.42
Rot. Bonds6

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

5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide (PubChem CID 24578806) has the molecular formula C21H15ClN2O4 and a molecular weight of 394.81 g/mol. Its IUPAC name is 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide
PubChem CID24578806
Molecular FormulaC21H15ClN2O4
Molecular Weight394.81 g/mol
Exact Mass394.07
IUPAC Name5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cc(Cl)ccc1OCc1cc(-c2ccco2)on1
InChIInChI=1S/C21H15ClN2O4/c22-14-8-9-18(17(11-14)21(25)23-15-5-2-1-3-6-15)27-13-16-12-20(28-24-16)19-7-4-10-26-19/h1-12H,13H2,(H,23,25)
InChIKeyVFYFPGOKDZLMCH-UHFFFAOYSA-N
XLogP5.42
TPSA77.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.81
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]acetamide
CID 30608039
5-chloro-2-[2-[1-(furan-2-yl)ethylamino]-2-oxoethoxy]-N-phenylbenzamide
CID 24578790
2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-4-methoxybenzamide
CID 18089227
4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]benzoic acid
CID 43214757
3-[(4-bromo-2-fluorophenoxy)methyl]-5-(furan-2-yl)-1,2-oxazole
CID 9354046
5-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenylmethoxybenzamide
CID 8799672
3-[(2,4-dimethylphenoxy)methyl]-5-(furan-2-yl)-1,2-oxazole
CID 112797314
[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2-chlorophenyl)acetate
CID 40752868
5-chloro-2-[2-(diethylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7893374
5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7893364
[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-[(2-phenylacetyl)amino]benzoate
CID 8809666
[4-chloro-2-[(4-chlorophenyl)carbamoyl]phenyl] N-phenylcarbamate
CID 127028067

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide?
The IUPAC name of 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide (CID 24578806) is 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide.
What is the SMILES notation for 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide?
The canonical SMILES for 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide is O=C(Nc1ccccc1)c1cc(Cl)ccc1OCc1cc(-c2ccco2)on1.
What is the InChIKey of 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide?
The InChIKey is VFYFPGOKDZLMCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClN2O4/c22-14-8-9-18(17(11-14)21(25)23-15-5-2-1-3-6-15)27-13-16-12-20(28-24-16)19-7-4-10-26-19/h1-12H,13H2,(H,23,25).
What are the key properties of 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide?
5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide has a molecular weight of 394.81 g/mol, XLogP of 5.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]-N-phenylbenzamide is sourced from PubChem (CID 24578806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).