2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide

C16H10Cl2N2O2 — CID 20546757

IUPAC2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide
SMILESO=C(Nc1cc(-c2ccc(Cl)cc2)on1)c1ccccc1Cl
InChIInChI=1S/C16H10Cl2N2O2/c17-11-7-5-10(6-8-11)14-9-15(20-22-14)19-16(21)12-3-1-2-4-13(12)18/h1-9H,(H,19,20,21)
InChIKeyLSAIBUFVVSQKFM-UHFFFAOYSA-N
MW333.17 g/mol
LogP4.90
Rot. Bonds3

About 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide

2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide (PubChem CID 20546757) has the molecular formula C16H10Cl2N2O2 and a molecular weight of 333.17 g/mol. Its IUPAC name is 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide
PubChem CID20546757
Molecular FormulaC16H10Cl2N2O2
Molecular Weight333.17 g/mol
Exact Mass332.01
IUPAC Name2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide
SMILESO=C(Nc1cc(-c2ccc(Cl)cc2)on1)c1ccccc1Cl
InChIInChI=1S/C16H10Cl2N2O2/c17-11-7-5-10(6-8-11)14-9-15(20-22-14)19-16(21)12-3-1-2-4-13(12)18/h1-9H,(H,19,20,21)
InChIKeyLSAIBUFVVSQKFM-UHFFFAOYSA-N
XLogP4.90
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.17
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-2-nitro-N-(5-phenyl-1,2-oxazol-3-yl)benzamide
CID 75425611
N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-2,2,2-trifluoroacetamide
CID 13035540
5-(4-chlorophenyl)-N-(2,3-dichlorophenyl)-1,2-oxazole-3-carboxamide
CID 100777051
1-(3,5-dichlorophenyl)-3-(5-phenyl-1,2-oxazol-3-yl)urea
CID 108812735
1-[2-(4-chlorophenyl)ethyl]-3-(5-phenyl-1,2-oxazol-3-yl)urea
CID 108812827
N-(5-chloro-2-pyridinyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 17022037
2-chloro-N-[6-(4-chloroanilino)pyridazin-3-yl]benzamide
CID 113047552
1-[2-(2-chlorophenyl)ethyl]-3-(5-phenyl-1,2-oxazol-3-yl)urea
CID 108812819
5-(4-chlorophenyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide
CID 24649242
5-(4-chlorophenyl)-N-[4-(4-chlorophenyl)sulfonylphenyl]-1,2-oxazole-3-carboxamide
CID 139582124
5-(4-chlorophenyl)-1,2-oxazole-3-carboxylic acid
CID 1133644
N-benzhydryl-2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]acetamide
CID 16878618

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide?
The IUPAC name of 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide (CID 20546757) is 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide?
The canonical SMILES for 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide is O=C(Nc1cc(-c2ccc(Cl)cc2)on1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide?
The InChIKey is LSAIBUFVVSQKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2O2/c17-11-7-5-10(6-8-11)14-9-15(20-22-14)19-16(21)12-3-1-2-4-13(12)18/h1-9H,(H,19,20,21).
What are the key properties of 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide?
2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide has a molecular weight of 333.17 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]benzamide is sourced from PubChem (CID 20546757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).