2-methyl-5-(oxolan-3-ylmethyl)pyridine

C11H15NO — CID 170611002

IUPAC2-methyl-5-(oxolan-3-ylmethyl)pyridine
SMILESCc1ccc(CC2CCOC2)cn1
InChIInChI=1S/C11H15NO/c1-9-2-3-10(7-12-9)6-11-4-5-13-8-11/h2-3,7,11H,4-6,8H2,1H3
InChIKeyOUBYNESRHYZENZ-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.97
Rot. Bonds2

About 2-methyl-5-(oxolan-3-ylmethyl)pyridine

2-methyl-5-(oxolan-3-ylmethyl)pyridine (PubChem CID 170611002) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-methyl-5-(oxolan-3-ylmethyl)pyridine.

Molecular Properties

Compound Name2-methyl-5-(oxolan-3-ylmethyl)pyridine
PubChem CID170611002
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-methyl-5-(oxolan-3-ylmethyl)pyridine
SMILESCc1ccc(CC2CCOC2)cn1
InChIInChI=1S/C11H15NO/c1-9-2-3-10(7-12-9)6-11-4-5-13-8-11/h2-3,7,11H,4-6,8H2,1H3
InChIKeyOUBYNESRHYZENZ-UHFFFAOYSA-N
XLogP1.97
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(oxolan-3-ylmethyl)pyridine?
The IUPAC name of 2-methyl-5-(oxolan-3-ylmethyl)pyridine (CID 170611002) is 2-methyl-5-(oxolan-3-ylmethyl)pyridine.
What is the SMILES notation for 2-methyl-5-(oxolan-3-ylmethyl)pyridine?
The canonical SMILES for 2-methyl-5-(oxolan-3-ylmethyl)pyridine is Cc1ccc(CC2CCOC2)cn1.
What is the InChIKey of 2-methyl-5-(oxolan-3-ylmethyl)pyridine?
The InChIKey is OUBYNESRHYZENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-9-2-3-10(7-12-9)6-11-4-5-13-8-11/h2-3,7,11H,4-6,8H2,1H3.
What are the key properties of 2-methyl-5-(oxolan-3-ylmethyl)pyridine?
2-methyl-5-(oxolan-3-ylmethyl)pyridine has a molecular weight of 177.25 g/mol, XLogP of 1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(oxolan-3-ylmethyl)pyridine is sourced from PubChem (CID 170611002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).