3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine

C7H10N2O2 — CID 15025942

IUPAC3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine
SMILESCOc1noc2c1CCNC2
InChIInChI=1S/C7H10N2O2/c1-10-7-5-2-3-8-4-6(5)11-9-7/h8H,2-4H2,1H3
InChIKeyQVKFUBNMZFAHLB-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.33
Rot. Bonds1

About 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine

3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine (PubChem CID 15025942) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine.

Molecular Properties

Compound Name3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine
PubChem CID15025942
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine
SMILESCOc1noc2c1CCNC2
InChIInChI=1S/C7H10N2O2/c1-10-7-5-2-3-8-4-6(5)11-9-7/h8H,2-4H2,1H3
InChIKeyQVKFUBNMZFAHLB-UHFFFAOYSA-N
XLogP0.33
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine?
The IUPAC name of 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine (CID 15025942) is 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine.
What is the SMILES notation for 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine?
The canonical SMILES for 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine is COc1noc2c1CCNC2.
What is the InChIKey of 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine?
The InChIKey is QVKFUBNMZFAHLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-10-7-5-2-3-8-4-6(5)11-9-7/h8H,2-4H2,1H3.
What are the key properties of 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine?
3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine has a molecular weight of 154.17 g/mol, XLogP of 0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine is sourced from PubChem (CID 15025942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).