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

C7H11N3O — CID 13324845

IUPAC1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine
SMILESCN1CCOc2cnn(C)c21
InChIInChI=1S/C7H11N3O/c1-9-3-4-11-6-5-8-10(2)7(6)9/h5H,3-4H2,1-2H3
InChIKeyDWPXCRKBWXHMPI-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.25
Rot. Bonds

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

1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine (PubChem CID 13324845) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine.

Molecular Properties

Compound Name1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine
PubChem CID13324845
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine
SMILESCN1CCOc2cnn(C)c21
InChIInChI=1S/C7H11N3O/c1-9-3-4-11-6-5-8-10(2)7(6)9/h5H,3-4H2,1-2H3
InChIKeyDWPXCRKBWXHMPI-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 ≤ 500153.19
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,7-dimethyl-5,6-dihydropyrazolo[4,5-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 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine?
The IUPAC name of 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine (CID 13324845) is 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine.
What is the SMILES notation for 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine?
The canonical SMILES for 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine is CN1CCOc2cnn(C)c21.
What is the InChIKey of 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine?
The InChIKey is DWPXCRKBWXHMPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-9-3-4-11-6-5-8-10(2)7(6)9/h5H,3-4H2,1-2H3.
What are the key properties of 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine?
1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine has a molecular weight of 153.19 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 1,7-dimethyl-5,6-dihydropyrazolo[4,5-b][1,4]oxazine is sourced from PubChem (CID 13324845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).