2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide

C19H18N2O4 — CID 135855896

IUPAC2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide
SMILESCCc1c(-c2ccc(OC)cc2)noc1-c1ccc(O)cc1C(N)=O
InChIInChI=1S/C19H18N2O4/c1-3-14-17(11-4-7-13(24-2)8-5-11)21-25-18(14)15-9-6-12(22)10-16(15)19(20)23/h4-10,22H,3H2,1-2H3,(H2,20,23)
InChIKeyONQRSHSOIIKHDN-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.38
Rot. Bonds5

About 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide

2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide (PubChem CID 135855896) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide.

Molecular Properties

Compound Name2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide
PubChem CID135855896
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide
SMILESCCc1c(-c2ccc(OC)cc2)noc1-c1ccc(O)cc1C(N)=O
InChIInChI=1S/C19H18N2O4/c1-3-14-17(11-4-7-13(24-2)8-5-11)21-25-18(14)15-9-6-12(22)10-16(15)19(20)23/h4-10,22H,3H2,1-2H3,(H2,20,23)
InChIKeyONQRSHSOIIKHDN-UHFFFAOYSA-N
XLogP3.38
TPSA98.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3,4-bis(4-methoxyphenyl)-1,2-oxazol-5-yl]phenol
CID 135855800
5-(2-chloro-4-methoxyphenyl)-4-ethyl-1,2-oxazole-3-carboxylic acid
CID 118514715
[5-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131868323
[5-(2,4-dimethoxyphenyl)-3-(3-methoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131867293
3-(4-ethyl-5-phenyl-1,2-oxazol-3-yl)phenol
CID 90029446
2-(2-formyl-4-methoxyphenyl)-5-methoxybenzamide
CID 174287412
[5-hydroxy-2-(4-methoxyphenyl)phenyl] acetate
CID 164597980
2-[3-amino-4-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4-ethyl-5-methoxyphenol
CID 952905
5-methoxy-2-(4-methoxyphenyl)phenol
CID 10933283
[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl carbamate
CID 46892996
3-(3,5-dimethoxyphenyl)-2-ethylbenzamide
CID 68986880
2-[4-(2-carbamoyl-5-methoxyphenyl)phenoxy]acetic acid
CID 67924191

Frequently Asked Questions

What is the IUPAC name of 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide?
The IUPAC name of 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide (CID 135855896) is 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide.
What is the SMILES notation for 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide?
The canonical SMILES for 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide is CCc1c(-c2ccc(OC)cc2)noc1-c1ccc(O)cc1C(N)=O.
What is the InChIKey of 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide?
The InChIKey is ONQRSHSOIIKHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-3-14-17(11-4-7-13(24-2)8-5-11)21-25-18(14)15-9-6-12(22)10-16(15)19(20)23/h4-10,22H,3H2,1-2H3,(H2,20,23).
What are the key properties of 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide?
2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide has a molecular weight of 338.36 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-ethyl-3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-5-hydroxybenzamide is sourced from PubChem (CID 135855896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).