N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide

C18H19N3O3 — CID 47083852

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)Nc3c(C)noc3C)o2)cc1
InChIInChI=1S/C18H19N3O3/c1-11-4-6-14(7-5-11)15-10-19-17(23-15)9-8-16(22)20-18-12(2)21-24-13(18)3/h4-7,10H,8-9H2,1-3H3,(H,20,22)
InChIKeyHORCJYNDIHSOBY-UHFFFAOYSA-N
MW325.37 g/mol
LogP3.83
Rot. Bonds5

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide (PubChem CID 47083852) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
PubChem CID47083852
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)Nc3c(C)noc3C)o2)cc1
InChIInChI=1S/C18H19N3O3/c1-11-4-6-14(7-5-11)15-10-19-17(23-15)9-8-16(22)20-18-12(2)21-24-13(18)3/h4-7,10H,8-9H2,1-3H3,(H,20,22)
InChIKeyHORCJYNDIHSOBY-UHFFFAOYSA-N
XLogP3.83
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide (CID 47083852) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide is Cc1ccc(-c2cnc(CCC(=O)Nc3c(C)noc3C)o2)cc1.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
The InChIKey is HORCJYNDIHSOBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-11-4-6-14(7-5-11)15-10-19-17(23-15)9-8-16(22)20-18-12(2)21-24-13(18)3/h4-7,10H,8-9H2,1-3H3,(H,20,22).
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide has a molecular weight of 325.37 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide is sourced from PubChem (CID 47083852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).