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

C11H12N4O4 — CID 62688302

IUPAC4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2nonc2N)c1
InChIInChI=1S/C11H12N4O4/c1-17-6-3-4-8(18-2)7(5-6)13-11(16)9-10(12)15-19-14-9/h3-5H,1-2H3,(H2,12,15)(H,13,16)
InChIKeySKSFFDMYBJKJMT-UHFFFAOYSA-N
MW264.24 g/mol
LogP0.92
Rot. Bonds4

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

4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide (PubChem CID 62688302) has the molecular formula C11H12N4O4 and a molecular weight of 264.24 g/mol. Its IUPAC name is 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
PubChem CID62688302
Molecular FormulaC11H12N4O4
Molecular Weight264.24 g/mol
Exact Mass264.09
IUPAC Name4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2nonc2N)c1
InChIInChI=1S/C11H12N4O4/c1-17-6-3-4-8(18-2)7(5-6)13-11(16)9-10(12)15-19-14-9/h3-5H,1-2H3,(H2,12,15)(H,13,16)
InChIKeySKSFFDMYBJKJMT-UHFFFAOYSA-N
XLogP0.92
TPSA112.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-amino-N-(2,5-dimethoxyphenyl)-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

Related Compounds

4-amino-N-(5-chloro-2-methoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688661
2-(4-amino-1,2,5-oxadiazol-3-yl)-N-(2,5-dimethoxyphenyl)acetamide
CID 82358201
4-amino-N-(3,4-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 17085500
3-[(2,5-dimethoxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 20866752
6-amino-N-(2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 62241119
5-amino-N-(2,5-dimethoxyphenyl)-1-phenyltriazole-4-carboxamide
CID 17015741
4-amino-N-[2-[(4-methoxyphenyl)carbamoylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide
CID 50748711
5-amino-N-(2,5-dimethoxyphenyl)-1-(4-methylphenyl)triazole-4-carboxamide
CID 17015721
N-(2,5-dimethoxyphenyl)-3,5-dimethylbenzamide
CID 918722
methyl 4-[(2,5-dimethoxyphenyl)carbamoyl]benzoate
CID 16585566
N-(2,5-dimethoxyphenyl)-6-methoxypyridazine-3-carboxamide
CID 90509292
3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 159900740

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide (CID 62688302) is 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide is COc1ccc(OC)c(NC(=O)c2nonc2N)c1.
What is the InChIKey of 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
The InChIKey is SKSFFDMYBJKJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O4/c1-17-6-3-4-8(18-2)7(5-6)13-11(16)9-10(12)15-19-14-9/h3-5H,1-2H3,(H2,12,15)(H,13,16).
What are the key properties of 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide?
4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide has a molecular weight of 264.24 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,5-dimethoxyphenyl)-1,2,5-oxadiazole-3-carboxamide is sourced from PubChem (CID 62688302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).