2,3,5-trimethyl-6-propan-2-ylpyridine

C11H17N — CID 89070171

IUPAC2,3,5-trimethyl-6-propan-2-ylpyridine
SMILESCc1cc(C)c(C(C)C)nc1C
InChIInChI=1S/C11H17N/c1-7(2)11-9(4)6-8(3)10(5)12-11/h6-7H,1-5H3
InChIKeyPBSSDVZYFMTMSW-UHFFFAOYSA-N
MW163.26 g/mol
LogP3.13
Rot. Bonds1

About 2,3,5-trimethyl-6-propan-2-ylpyridine

2,3,5-trimethyl-6-propan-2-ylpyridine (PubChem CID 89070171) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 2,3,5-trimethyl-6-propan-2-ylpyridine.

Molecular Properties

Compound Name2,3,5-trimethyl-6-propan-2-ylpyridine
PubChem CID89070171
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name2,3,5-trimethyl-6-propan-2-ylpyridine
SMILESCc1cc(C)c(C(C)C)nc1C
InChIInChI=1S/C11H17N/c1-7(2)11-9(4)6-8(3)10(5)12-11/h6-7H,1-5H3
InChIKeyPBSSDVZYFMTMSW-UHFFFAOYSA-N
XLogP3.13
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-6-propan-2-ylpyridine?
The IUPAC name of 2,3,5-trimethyl-6-propan-2-ylpyridine (CID 89070171) is 2,3,5-trimethyl-6-propan-2-ylpyridine.
What is the SMILES notation for 2,3,5-trimethyl-6-propan-2-ylpyridine?
The canonical SMILES for 2,3,5-trimethyl-6-propan-2-ylpyridine is Cc1cc(C)c(C(C)C)nc1C.
What is the InChIKey of 2,3,5-trimethyl-6-propan-2-ylpyridine?
The InChIKey is PBSSDVZYFMTMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-7(2)11-9(4)6-8(3)10(5)12-11/h6-7H,1-5H3.
What are the key properties of 2,3,5-trimethyl-6-propan-2-ylpyridine?
2,3,5-trimethyl-6-propan-2-ylpyridine has a molecular weight of 163.26 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-6-propan-2-ylpyridine is sourced from PubChem (CID 89070171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).