2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide

C15H13N3O3 — CID 87428377

IUPAC2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide
SMILESCc1c(C(N)=O)cc(-c2ncco2)c(C)c1-c1cocn1
InChIInChI=1S/C15H13N3O3/c1-8-10(14(16)19)5-11(15-17-3-4-21-15)9(2)13(8)12-6-20-7-18-12/h3-7H,1-2H3,(H2,16,19)
InChIKeyLFLFWDWVLVEBID-UHFFFAOYSA-N
MW283.29 g/mol
LogP2.71
Rot. Bonds3

About 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide

2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide (PubChem CID 87428377) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide
PubChem CID87428377
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide
SMILESCc1c(C(N)=O)cc(-c2ncco2)c(C)c1-c1cocn1
InChIInChI=1S/C15H13N3O3/c1-8-10(14(16)19)5-11(15-17-3-4-21-15)9(2)13(8)12-6-20-7-18-12/h3-7H,1-2H3,(H2,16,19)
InChIKeyLFLFWDWVLVEBID-UHFFFAOYSA-N
XLogP2.71
TPSA95.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide?
The IUPAC name of 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide (CID 87428377) is 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide.
What is the SMILES notation for 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide?
The canonical SMILES for 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide is Cc1c(C(N)=O)cc(-c2ncco2)c(C)c1-c1cocn1.
What is the InChIKey of 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide?
The InChIKey is LFLFWDWVLVEBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-8-10(14(16)19)5-11(15-17-3-4-21-15)9(2)13(8)12-6-20-7-18-12/h3-7H,1-2H3,(H2,16,19).
What are the key properties of 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide?
2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide has a molecular weight of 283.29 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-(1,3-oxazol-2-yl)-3-(1,3-oxazol-4-yl)benzamide is sourced from PubChem (CID 87428377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).