bis(2,3-dimethylpyridine);ethane

C18H30N2 — CID 159594018

IUPACbis(2,3-dimethylpyridine);ethane
SMILESCC.CC.Cc1cccnc1C.Cc1cccnc1C
InChIInChI=1S/2C7H9N.2C2H6/c2*1-6-4-3-5-8-7(6)2;2*1-2/h2*3-5H,1-2H3;2*1-2H3
InChIKeyMKPGWIBZVCQRHV-UHFFFAOYSA-N
MW274.45 g/mol
LogP5.45
Rot. Bonds

About bis(2,3-dimethylpyridine);ethane

bis(2,3-dimethylpyridine);ethane (PubChem CID 159594018) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is bis(2,3-dimethylpyridine);ethane.

Molecular Properties

Compound Namebis(2,3-dimethylpyridine);ethane
PubChem CID159594018
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Namebis(2,3-dimethylpyridine);ethane
SMILESCC.CC.Cc1cccnc1C.Cc1cccnc1C
InChIInChI=1S/2C7H9N.2C2H6/c2*1-6-4-3-5-8-7(6)2;2*1-2/h2*3-5H,1-2H3;2*1-2H3
InChIKeyMKPGWIBZVCQRHV-UHFFFAOYSA-N
XLogP5.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.45
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethylpyridine;1,4-xylene
CID 174745079
buta-1,3-diene;2,3-dimethylpyridine;ethane
CID 145249818
2,3-dimethylpyridine;formamide;hydrate
CID 175110807
2-bromo-3-methylpyridine;ethane
CID 143610978
ethane;methanamine;2-methyl-3-[2-(2-methylphenyl)ethyl]pyridine
CID 165410147
1,3-dichloro-2-methylbenzene;bis(2,3-dimethylpyridine);1-fluoro-2-methylbenzene
CID 158361621
3-tert-butyl-2-methylpyridine;ethane
CID 90980079
ethane;2-methyl-3-propan-2-ylpyridine
CID 142858508
ethane;3-ethyl-2-methylpyridine
CID 143071594
ethane;2-methyl-3-propan-2-ylpyridine;vanadium
CID 143650392
methoxymethane;3-methylpyridin-2-amine
CID 142348172
azane;2-methylpyridin-3-amine
CID 67996717

Frequently Asked Questions

What is the IUPAC name of bis(2,3-dimethylpyridine);ethane?
The IUPAC name of bis(2,3-dimethylpyridine);ethane (CID 159594018) is bis(2,3-dimethylpyridine);ethane.
What is the SMILES notation for bis(2,3-dimethylpyridine);ethane?
The canonical SMILES for bis(2,3-dimethylpyridine);ethane is CC.CC.Cc1cccnc1C.Cc1cccnc1C.
What is the InChIKey of bis(2,3-dimethylpyridine);ethane?
The InChIKey is MKPGWIBZVCQRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H9N.2C2H6/c2*1-6-4-3-5-8-7(6)2;2*1-2/h2*3-5H,1-2H3;2*1-2H3.
What are the key properties of bis(2,3-dimethylpyridine);ethane?
bis(2,3-dimethylpyridine);ethane has a molecular weight of 274.45 g/mol, XLogP of 5.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,3-dimethylpyridine);ethane is sourced from PubChem (CID 159594018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).