6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol

C8H12N2O2 — CID 121208345

IUPAC6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol
SMILESCC1(C)COc2c(O)cnn2C1
InChIInChI=1S/C8H12N2O2/c1-8(2)4-10-7(12-5-8)6(11)3-9-10/h3,11H,4-5H2,1-2H3
InChIKeyRMUGCRZXBWEBKV-UHFFFAOYSA-N
MW168.20 g/mol
LogP1.01
Rot. Bonds

About 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol

6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol (PubChem CID 121208345) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol.

Molecular Properties

Compound Name6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol
PubChem CID121208345
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol
SMILESCC1(C)COc2c(O)cnn2C1
InChIInChI=1S/C8H12N2O2/c1-8(2)4-10-7(12-5-8)6(11)3-9-10/h3,11H,4-5H2,1-2H3
InChIKeyRMUGCRZXBWEBKV-UHFFFAOYSA-N
XLogP1.01
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol?
The IUPAC name of 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol (CID 121208345) is 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol.
What is the SMILES notation for 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol?
The canonical SMILES for 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol is CC1(C)COc2c(O)cnn2C1.
What is the InChIKey of 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol?
The InChIKey is RMUGCRZXBWEBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-8(2)4-10-7(12-5-8)6(11)3-9-10/h3,11H,4-5H2,1-2H3.
What are the key properties of 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol?
6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol has a molecular weight of 168.20 g/mol, XLogP of 1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-5,7-dihydropyrazolo[5,1-b][1,3]oxazin-3-ol is sourced from PubChem (CID 121208345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).