N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide

C10H6Cl2N2O2 — CID 2744443

IUPACN-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1ccno1
InChIInChI=1S/C10H6Cl2N2O2/c11-6-3-7(12)5-8(4-6)14-10(15)9-1-2-13-16-9/h1-5H,(H,14,15)
InChIKeyUHILGSFZUXPNBO-UHFFFAOYSA-N
MW257.08 g/mol
LogP3.23
Rot. Bonds2

About N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide

N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide (PubChem CID 2744443) has the molecular formula C10H6Cl2N2O2 and a molecular weight of 257.08 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide
PubChem CID2744443
Molecular FormulaC10H6Cl2N2O2
Molecular Weight257.08 g/mol
Exact Mass255.98
IUPAC NameN-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)c1ccno1
InChIInChI=1S/C10H6Cl2N2O2/c11-6-3-7(12)5-8(4-6)14-10(15)9-1-2-13-16-9/h1-5H,(H,14,15)
InChIKeyUHILGSFZUXPNBO-UHFFFAOYSA-N
XLogP3.23
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.08
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dichlorophenyl)-1,2-oxazole-5-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-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide (CID 2744443) is N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)c1ccno1.
What is the InChIKey of N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide?
The InChIKey is UHILGSFZUXPNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O2/c11-6-3-7(12)5-8(4-6)14-10(15)9-1-2-13-16-9/h1-5H,(H,14,15).
What are the key properties of N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide?
N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide has a molecular weight of 257.08 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 2744443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).