N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide

C10H9N3O3 — CID 51031223

IUPACN-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnon2)cc1
InChIInChI=1S/C10H9N3O3/c1-15-8-4-2-7(3-5-8)12-10(14)9-6-11-16-13-9/h2-6H,1H3,(H,12,14)
InChIKeySWGQXHBNUNQZKC-UHFFFAOYSA-N
MW219.20 g/mol
LogP1.33
Rot. Bonds3

About N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide

N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide (PubChem CID 51031223) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
PubChem CID51031223
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC NameN-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnon2)cc1
InChIInChI=1S/C10H9N3O3/c1-15-8-4-2-7(3-5-8)12-10(14)9-6-11-16-13-9/h2-6H,1H3,(H,12,14)
InChIKeySWGQXHBNUNQZKC-UHFFFAOYSA-N
XLogP1.33
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-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-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide (CID 51031223) is N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide is COc1ccc(NC(=O)c2cnon2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The InChIKey is SWGQXHBNUNQZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c1-15-8-4-2-7(3-5-8)12-10(14)9-6-11-16-13-9/h2-6H,1H3,(H,12,14).
What are the key properties of N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide has a molecular weight of 219.20 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide is sourced from PubChem (CID 51031223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).