ethane;pyridine;2,4,6-trimethylpyridine

C15H22N2 — CID 162731023

IUPACethane;pyridine;2,4,6-trimethylpyridine
SMILESCC.Cc1cc(C)nc(C)c1.c1ccncc1
InChIInChI=1S/C8H11N.C5H5N.C2H6/c1-6-4-7(2)9-8(3)5-6;1-2-4-6-5-3-1;1-2/h4-5H,1-3H3;1-5H;1-2H3
InChIKeyBFNLFCXILKLAAO-UHFFFAOYSA-N
MW230.35 g/mol
LogP4.11
Rot. Bonds

About ethane;pyridine;2,4,6-trimethylpyridine

ethane;pyridine;2,4,6-trimethylpyridine (PubChem CID 162731023) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is ethane;pyridine;2,4,6-trimethylpyridine.

Molecular Properties

Compound Nameethane;pyridine;2,4,6-trimethylpyridine
PubChem CID162731023
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Nameethane;pyridine;2,4,6-trimethylpyridine
SMILESCC.Cc1cc(C)nc(C)c1.c1ccncc1
InChIInChI=1S/C8H11N.C5H5N.C2H6/c1-6-4-7(2)9-8(3)5-6;1-2-4-6-5-3-1;1-2/h4-5H,1-3H3;1-5H;1-2H3
InChIKeyBFNLFCXILKLAAO-UHFFFAOYSA-N
XLogP4.11
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;pyridine;2,4,6-trimethylpyridine?
The IUPAC name of ethane;pyridine;2,4,6-trimethylpyridine (CID 162731023) is ethane;pyridine;2,4,6-trimethylpyridine.
What is the SMILES notation for ethane;pyridine;2,4,6-trimethylpyridine?
The canonical SMILES for ethane;pyridine;2,4,6-trimethylpyridine is CC.Cc1cc(C)nc(C)c1.c1ccncc1.
What is the InChIKey of ethane;pyridine;2,4,6-trimethylpyridine?
The InChIKey is BFNLFCXILKLAAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C5H5N.C2H6/c1-6-4-7(2)9-8(3)5-6;1-2-4-6-5-3-1;1-2/h4-5H,1-3H3;1-5H;1-2H3.
What are the key properties of ethane;pyridine;2,4,6-trimethylpyridine?
ethane;pyridine;2,4,6-trimethylpyridine has a molecular weight of 230.35 g/mol, XLogP of 4.11, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;pyridine;2,4,6-trimethylpyridine is sourced from PubChem (CID 162731023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).