N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide

C24H19ClN2O4 — CID 139918040

IUPACN-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2oc(-c3ccccc3)nc2-c2ccccc2Cl)c(O)c1
InChIInChI=1S/C24H19ClN2O4/c1-30-17-12-11-16(20(28)14-17)13-21(29)26-24-22(18-9-5-6-10-19(18)25)27-23(31-24)15-7-3-2-4-8-15/h2-12,14,28H,13H2,1H3,(H,26,29)
InChIKeySLIXEDMEPQHOSN-UHFFFAOYSA-N
MW434.88 g/mol
LogP5.56
Rot. Bonds6

About N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide

N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide (PubChem CID 139918040) has the molecular formula C24H19ClN2O4 and a molecular weight of 434.88 g/mol. Its IUPAC name is N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide
PubChem CID139918040
Molecular FormulaC24H19ClN2O4
Molecular Weight434.88 g/mol
Exact Mass434.10
IUPAC NameN-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2oc(-c3ccccc3)nc2-c2ccccc2Cl)c(O)c1
InChIInChI=1S/C24H19ClN2O4/c1-30-17-12-11-16(20(28)14-17)13-21(29)26-24-22(18-9-5-6-10-19(18)25)27-23(31-24)15-7-3-2-4-8-15/h2-12,14,28H,13H2,1H3,(H,26,29)
InChIKeySLIXEDMEPQHOSN-UHFFFAOYSA-N
XLogP5.56
TPSA84.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.88
LogP ≤ 55.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(4-fluoro-2-hydroxyphenyl)acetamide
CID 139917923
N-[4-(2,6-dichlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(4-fluoro-2-hydroxyphenyl)acetamide
CID 139917925
2-(4-chloro-2-hydroxyphenyl)-N-[4-(4-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]acetamide
CID 139918056
N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]acetamide
CID 139917835
N-[4-(2,6-dichlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-[2-hydroxy-4-(trifluoromethyl)phenyl]acetamide
CID 139917924
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-(3-methoxyphenyl)-1,3-oxazol-5-yl]acetamide
CID 57224621
N-[4-(2,6-dichlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methylphenyl)benzamide
CID 139917941
N-(2-chloro-5-methoxyphenyl)-2-(2-hydroxyphenyl)acetamide
CID 80741109
N-[4-(2-chlorophenyl)-2-(2-hydroxy-4-naphthalen-1-ylphenyl)-1,3-oxazol-5-yl]benzamide
CID 139918004
2-(2-chloro-4-methoxyphenyl)-N-(5-methyl-4-phenyl-1H-pyrazol-3-yl)acetamide
CID 53198503
2-[[(2-chlorophenyl)methylamino]methyl]-5-methoxyphenol
CID 61268747
4-[(2-hydroxy-4-methoxyphenyl)methylamino]-4-oxobutanoic acid
CID 20993607

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide?
The IUPAC name of N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide (CID 139918040) is N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide?
The canonical SMILES for N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2oc(-c3ccccc3)nc2-c2ccccc2Cl)c(O)c1.
What is the InChIKey of N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide?
The InChIKey is SLIXEDMEPQHOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClN2O4/c1-30-17-12-11-16(20(28)14-17)13-21(29)26-24-22(18-9-5-6-10-19(18)25)27-23(31-24)15-7-3-2-4-8-15/h2-12,14,28H,13H2,1H3,(H,26,29).
What are the key properties of N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide?
N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide has a molecular weight of 434.88 g/mol, XLogP of 5.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]-2-(2-hydroxy-4-methoxyphenyl)acetamide is sourced from PubChem (CID 139918040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).