2-methyl-3-pyridin-2-yl-1,2-oxazolidine

C9H12N2O — CID 101179409

IUPAC2-methyl-3-pyridin-2-yl-1,2-oxazolidine
SMILESCN1OCCC1c1ccccn1
InChIInChI=1S/C9H12N2O/c1-11-9(5-7-12-11)8-4-2-3-6-10-8/h2-4,6,9H,5,7H2,1H3
InChIKeyMMVUEMNNDFVYDL-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.39
Rot. Bonds1

About 2-methyl-3-pyridin-2-yl-1,2-oxazolidine

2-methyl-3-pyridin-2-yl-1,2-oxazolidine (PubChem CID 101179409) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-methyl-3-pyridin-2-yl-1,2-oxazolidine.

Molecular Properties

Compound Name2-methyl-3-pyridin-2-yl-1,2-oxazolidine
PubChem CID101179409
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-methyl-3-pyridin-2-yl-1,2-oxazolidine
SMILESCN1OCCC1c1ccccn1
InChIInChI=1S/C9H12N2O/c1-11-9(5-7-12-11)8-4-2-3-6-10-8/h2-4,6,9H,5,7H2,1H3
InChIKeyMMVUEMNNDFVYDL-UHFFFAOYSA-N
XLogP1.39
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-pyridin-2-yl-1,2-oxazolidine?
The IUPAC name of 2-methyl-3-pyridin-2-yl-1,2-oxazolidine (CID 101179409) is 2-methyl-3-pyridin-2-yl-1,2-oxazolidine.
What is the SMILES notation for 2-methyl-3-pyridin-2-yl-1,2-oxazolidine?
The canonical SMILES for 2-methyl-3-pyridin-2-yl-1,2-oxazolidine is CN1OCCC1c1ccccn1.
What is the InChIKey of 2-methyl-3-pyridin-2-yl-1,2-oxazolidine?
The InChIKey is MMVUEMNNDFVYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-11-9(5-7-12-11)8-4-2-3-6-10-8/h2-4,6,9H,5,7H2,1H3.
What are the key properties of 2-methyl-3-pyridin-2-yl-1,2-oxazolidine?
2-methyl-3-pyridin-2-yl-1,2-oxazolidine has a molecular weight of 164.21 g/mol, XLogP of 1.39, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-pyridin-2-yl-1,2-oxazolidine is sourced from PubChem (CID 101179409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).