3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine

C7H10N2O — CID 83478998

IUPAC3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine
SMILESCc1noc2c1NCCC2
InChIInChI=1S/C7H10N2O/c1-5-7-6(10-9-5)3-2-4-8-7/h8H,2-4H2,1H3
InChIKeyMAISYWFAPPUVLX-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.34
Rot. Bonds

About 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine

3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine (PubChem CID 83478998) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine
PubChem CID83478998
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine
SMILESCc1noc2c1NCCC2
InChIInChI=1S/C7H10N2O/c1-5-7-6(10-9-5)3-2-4-8-7/h8H,2-4H2,1H3
InChIKeyMAISYWFAPPUVLX-UHFFFAOYSA-N
XLogP1.34
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine 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 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine?
The IUPAC name of 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine (CID 83478998) is 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine?
The canonical SMILES for 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine is Cc1noc2c1NCCC2.
What is the InChIKey of 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine?
The InChIKey is MAISYWFAPPUVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-7-6(10-9-5)3-2-4-8-7/h8H,2-4H2,1H3.
What are the key properties of 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine?
3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine has a molecular weight of 138.17 g/mol, XLogP of 1.34, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 83478998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).