2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine

C7H11N3O — CID 13370297

IUPAC2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine
SMILESCN1CCOc2cn(C)nc21
InChIInChI=1S/C7H11N3O/c1-9-3-4-11-6-5-10(2)8-7(6)9/h5H,3-4H2,1-2H3
InChIKeyXIRMXWPUJINGIC-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.25
Rot. Bonds

About 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine

2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine (PubChem CID 13370297) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine.

Molecular Properties

Compound Name2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine
PubChem CID13370297
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine
SMILESCN1CCOc2cn(C)nc21
InChIInChI=1S/C7H11N3O/c1-9-3-4-11-6-5-10(2)8-7(6)9/h5H,3-4H2,1-2H3
InChIKeyXIRMXWPUJINGIC-UHFFFAOYSA-N
XLogP0.25
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine 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 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine?
The IUPAC name of 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine (CID 13370297) is 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine.
What is the SMILES notation for 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine?
The canonical SMILES for 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine is CN1CCOc2cn(C)nc21.
What is the InChIKey of 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine?
The InChIKey is XIRMXWPUJINGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-9-3-4-11-6-5-10(2)8-7(6)9/h5H,3-4H2,1-2H3.
What are the key properties of 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine?
2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine has a molecular weight of 153.18 g/mol, XLogP of 0.25, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-5,6-dihydropyrazolo[4,3-b][1,4]oxazine is sourced from PubChem (CID 13370297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).