6-ethenyl-2-methyl-3-propan-2-ylpyridine

C11H15N — CID 164556362

IUPAC6-ethenyl-2-methyl-3-propan-2-ylpyridine
SMILESC=Cc1ccc(C(C)C)c(C)n1
InChIInChI=1S/C11H15N/c1-5-10-6-7-11(8(2)3)9(4)12-10/h5-8H,1H2,2-4H3
InChIKeyUCFHUGUOJYARTF-UHFFFAOYSA-N
MW161.25 g/mol
LogP3.16
Rot. Bonds2

About 6-ethenyl-2-methyl-3-propan-2-ylpyridine

6-ethenyl-2-methyl-3-propan-2-ylpyridine (PubChem CID 164556362) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 6-ethenyl-2-methyl-3-propan-2-ylpyridine.

Molecular Properties

Compound Name6-ethenyl-2-methyl-3-propan-2-ylpyridine
PubChem CID164556362
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name6-ethenyl-2-methyl-3-propan-2-ylpyridine
SMILESC=Cc1ccc(C(C)C)c(C)n1
InChIInChI=1S/C11H15N/c1-5-10-6-7-11(8(2)3)9(4)12-10/h5-8H,1H2,2-4H3
InChIKeyUCFHUGUOJYARTF-UHFFFAOYSA-N
XLogP3.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-2-methyl-3-propan-2-ylpyridine?
The IUPAC name of 6-ethenyl-2-methyl-3-propan-2-ylpyridine (CID 164556362) is 6-ethenyl-2-methyl-3-propan-2-ylpyridine.
What is the SMILES notation for 6-ethenyl-2-methyl-3-propan-2-ylpyridine?
The canonical SMILES for 6-ethenyl-2-methyl-3-propan-2-ylpyridine is C=Cc1ccc(C(C)C)c(C)n1.
What is the InChIKey of 6-ethenyl-2-methyl-3-propan-2-ylpyridine?
The InChIKey is UCFHUGUOJYARTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-5-10-6-7-11(8(2)3)9(4)12-10/h5-8H,1H2,2-4H3.
What are the key properties of 6-ethenyl-2-methyl-3-propan-2-ylpyridine?
6-ethenyl-2-methyl-3-propan-2-ylpyridine has a molecular weight of 161.25 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-2-methyl-3-propan-2-ylpyridine is sourced from PubChem (CID 164556362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).