2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine

C11H16N2 — CID 142297268

IUPAC2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine
SMILESCc1cccc(N2CC(C)(C)C2)n1
InChIInChI=1S/C11H16N2/c1-9-5-4-6-10(12-9)13-7-11(2,3)8-13/h4-6H,7-8H2,1-3H3
InChIKeyULHQGRUXISMFJW-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.24
Rot. Bonds1

About 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine

2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine (PubChem CID 142297268) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine.

Molecular Properties

Compound Name2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine
PubChem CID142297268
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine
SMILESCc1cccc(N2CC(C)(C)C2)n1
InChIInChI=1S/C11H16N2/c1-9-5-4-6-10(12-9)13-7-11(2,3)8-13/h4-6H,7-8H2,1-3H3
InChIKeyULHQGRUXISMFJW-UHFFFAOYSA-N
XLogP2.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine?
The IUPAC name of 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine (CID 142297268) is 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine.
What is the SMILES notation for 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine?
The canonical SMILES for 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine is Cc1cccc(N2CC(C)(C)C2)n1.
What is the InChIKey of 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine?
The InChIKey is ULHQGRUXISMFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-9-5-4-6-10(12-9)13-7-11(2,3)8-13/h4-6H,7-8H2,1-3H3.
What are the key properties of 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine?
2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine has a molecular weight of 176.26 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine is sourced from PubChem (CID 142297268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).