2-butyl-2,6-dimethyl-1H-pyridine

C11H19N — CID 66968989

IUPAC2-butyl-2,6-dimethyl-1H-pyridine
SMILESCCCCC1(C)C=CC=C(C)N1
InChIInChI=1S/C11H19N/c1-4-5-8-11(3)9-6-7-10(2)12-11/h6-7,9,12H,4-5,8H2,1-3H3
InChIKeyGEZURIBXSPTLKH-UHFFFAOYSA-N
MW165.28 g/mol
LogP3.00
Rot. Bonds3

About 2-butyl-2,6-dimethyl-1H-pyridine

2-butyl-2,6-dimethyl-1H-pyridine (PubChem CID 66968989) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 2-butyl-2,6-dimethyl-1H-pyridine.

Molecular Properties

Compound Name2-butyl-2,6-dimethyl-1H-pyridine
PubChem CID66968989
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name2-butyl-2,6-dimethyl-1H-pyridine
SMILESCCCCC1(C)C=CC=C(C)N1
InChIInChI=1S/C11H19N/c1-4-5-8-11(3)9-6-7-10(2)12-11/h6-7,9,12H,4-5,8H2,1-3H3
InChIKeyGEZURIBXSPTLKH-UHFFFAOYSA-N
XLogP3.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-butyl-2,6-dimethyl-1H-pyridine?
The IUPAC name of 2-butyl-2,6-dimethyl-1H-pyridine (CID 66968989) is 2-butyl-2,6-dimethyl-1H-pyridine.
What is the SMILES notation for 2-butyl-2,6-dimethyl-1H-pyridine?
The canonical SMILES for 2-butyl-2,6-dimethyl-1H-pyridine is CCCCC1(C)C=CC=C(C)N1.
What is the InChIKey of 2-butyl-2,6-dimethyl-1H-pyridine?
The InChIKey is GEZURIBXSPTLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-4-5-8-11(3)9-6-7-10(2)12-11/h6-7,9,12H,4-5,8H2,1-3H3.
What are the key properties of 2-butyl-2,6-dimethyl-1H-pyridine?
2-butyl-2,6-dimethyl-1H-pyridine has a molecular weight of 165.28 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-2,6-dimethyl-1H-pyridine is sourced from PubChem (CID 66968989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).