3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine

C7H10N2O — CID 58125499

IUPAC3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine
SMILESCc1cnn2c1OCCC2
InChIInChI=1S/C7H10N2O/c1-6-5-8-9-3-2-4-10-7(6)9/h5H,2-4H2,1H3
InChIKeyWKKRPWQNOWSFPK-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.97
Rot. Bonds

About 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine

3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine (PubChem CID 58125499) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine.

Molecular Properties

Compound Name3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine
PubChem CID58125499
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine
SMILESCc1cnn2c1OCCC2
InChIInChI=1S/C7H10N2O/c1-6-5-8-9-3-2-4-10-7(6)9/h5H,2-4H2,1H3
InChIKeyWKKRPWQNOWSFPK-UHFFFAOYSA-N
XLogP0.97
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine?
The IUPAC name of 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine (CID 58125499) is 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine.
What is the SMILES notation for 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine?
The canonical SMILES for 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine is Cc1cnn2c1OCCC2.
What is the InChIKey of 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine?
The InChIKey is WKKRPWQNOWSFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-6-5-8-9-3-2-4-10-7(6)9/h5H,2-4H2,1H3.
What are the key properties of 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine?
3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine has a molecular weight of 138.17 g/mol, XLogP of 0.97, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine is sourced from PubChem (CID 58125499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).