N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide

C17H16N2O4 — CID 6492575

IUPACN-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
SMILESCc1cccc(OCc2ccc(C(=O)Nc3cc(C)on3)o2)c1
InChIInChI=1S/C17H16N2O4/c1-11-4-3-5-13(8-11)21-10-14-6-7-15(22-14)17(20)18-16-9-12(2)23-19-16/h3-9H,10H2,1-2H3,(H,18,19,20)
InChIKeyCPPLZCVHKRJNDX-UHFFFAOYSA-N
MW312.33 g/mol
LogP3.72
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide (PubChem CID 6492575) has the molecular formula C17H16N2O4 and a molecular weight of 312.33 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
PubChem CID6492575
Molecular FormulaC17H16N2O4
Molecular Weight312.33 g/mol
Exact Mass312.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
SMILESCc1cccc(OCc2ccc(C(=O)Nc3cc(C)on3)o2)c1
InChIInChI=1S/C17H16N2O4/c1-11-4-3-5-13(8-11)21-10-14-6-7-15(22-14)17(20)18-16-9-12(2)23-19-16/h3-9H,10H2,1-2H3,(H,18,19,20)
InChIKeyCPPLZCVHKRJNDX-UHFFFAOYSA-N
XLogP3.72
TPSA77.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide (CID 6492575) is N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide is Cc1cccc(OCc2ccc(C(=O)Nc3cc(C)on3)o2)c1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is CPPLZCVHKRJNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O4/c1-11-4-3-5-13(8-11)21-10-14-6-7-15(22-14)17(20)18-16-9-12(2)23-19-16/h3-9H,10H2,1-2H3,(H,18,19,20).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-5-[(3-methylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 6492575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).