5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine

C10H5Cl2N5O — CID 911346

IUPAC5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
SMILESClc1ccc(Nc2nc3nonc3nc2Cl)cc1
InChIInChI=1S/C10H5Cl2N5O/c11-5-1-3-6(4-2-5)13-8-7(12)14-9-10(15-8)17-18-16-9/h1-4H,(H,13,15,17)
InChIKeyIVVLYHLUOFTLPT-UHFFFAOYSA-N
MW282.09 g/mol
LogP3.06
Rot. Bonds2

About 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine

5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine (PubChem CID 911346) has the molecular formula C10H5Cl2N5O and a molecular weight of 282.09 g/mol. Its IUPAC name is 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine.

Molecular Properties

Compound Name5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
PubChem CID911346
Molecular FormulaC10H5Cl2N5O
Molecular Weight282.09 g/mol
Exact Mass280.99
IUPAC Name5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
SMILESClc1ccc(Nc2nc3nonc3nc2Cl)cc1
InChIInChI=1S/C10H5Cl2N5O/c11-5-1-3-6(4-2-5)13-8-7(12)14-9-10(15-8)17-18-16-9/h1-4H,(H,13,15,17)
InChIKeyIVVLYHLUOFTLPT-UHFFFAOYSA-N
XLogP3.06
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.09
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine 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 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The IUPAC name of 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine (CID 911346) is 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine.
What is the SMILES notation for 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The canonical SMILES for 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine is Clc1ccc(Nc2nc3nonc3nc2Cl)cc1.
What is the InChIKey of 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
The InChIKey is IVVLYHLUOFTLPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2N5O/c11-5-1-3-6(4-2-5)13-8-7(12)14-9-10(15-8)17-18-16-9/h1-4H,(H,13,15,17).
What are the key properties of 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine?
5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine has a molecular weight of 282.09 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine is sourced from PubChem (CID 911346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).