2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine

C25H30N2OS — CID 159094566

IUPAC2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine
SMILESC=Cc1cccs1.CCc1ccco1.Cc1ccnc(C)c1.Cc1ccncc1
InChIInChI=1S/C7H9N.C6H7N.C6H8O.C6H6S/c1-6-3-4-8-7(2)5-6;1-6-2-4-7-5-3-6;2*1-2-6-4-3-5-7-6/h3-5H,1-2H3;2-5H,1H3;3-5H,2H2,1H3;2-5H,1H2
InChIKeyKCMQMIPRNAZZMZ-UHFFFAOYSA-N
MW406.60 g/mol
LogP7.32
Rot. Bonds2

About 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine

2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine (PubChem CID 159094566) has the molecular formula C25H30N2OS and a molecular weight of 406.60 g/mol. Its IUPAC name is 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine.

Molecular Properties

Compound Name2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine
PubChem CID159094566
Molecular FormulaC25H30N2OS
Molecular Weight406.60 g/mol
Exact Mass406.21
IUPAC Name2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine
SMILESC=Cc1cccs1.CCc1ccco1.Cc1ccnc(C)c1.Cc1ccncc1
InChIInChI=1S/C7H9N.C6H7N.C6H8O.C6H6S/c1-6-3-4-8-7(2)5-6;1-6-2-4-7-5-3-6;2*1-2-6-4-3-5-7-6/h3-5H,1-2H3;2-5H,1H3;3-5H,2H2,1H3;2-5H,1H2
InChIKeyKCMQMIPRNAZZMZ-UHFFFAOYSA-N
XLogP7.32
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.60
LogP ≤ 57.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-Methyl-furan-3-ylsulfanyl)-thieno[2,3-c]pyridine-2-carboxylic acid amide
CID 9879093
[5-[4-(Furan-2-yl)-3-pyridinyl]thiophen-2-yl]methanamine;dihydrochloride
CID 145955289
15-(Furan-3-yl)-13-(4-methyl-1,3-thiazol-2-yl)-4,11-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,13-pentaen-12-one
CID 44291331
2-(5-Chlorothiophen-2-yl)-4-(furan-3-yl)-6-pyridin-3-ylpyridine
CID 46229631
4-Furan-2-yl-2-((E)-2-furan-2-yl-vinyl)-6-thiophen-2-yl-pyridine
CID 10064551
2-(Furan-2-yl)-6-pyridin-4-yl-4-thiophen-2-ylpyridine
CID 44423803
2-(Furan-2-yl)-6-pyridin-4-yl-4-thiophen-3-ylpyridine
CID 44423806
4-(Furan-3-yl)-2-pyridin-4-yl-6-thiophen-2-ylpyridine
CID 44423810
4-(Furan-3-yl)-2-pyridin-4-yl-6-thiophen-3-ylpyridine
CID 44423829
4-(Furan-2-yl)-2-pyridin-4-yl-6-thiophen-3-ylpyridine
CID 44423834
4-(Furan-2-yl)-2-pyridin-3-yl-6-thiophen-2-ylpyridine
CID 44423836
4-(5-Chlorofuran-2-yl)-2-pyridin-3-yl-6-thiophen-2-ylpyridine
CID 46229231

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine?
The IUPAC name of 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine (CID 159094566) is 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine.
What is the SMILES notation for 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine?
The canonical SMILES for 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine is C=Cc1cccs1.CCc1ccco1.Cc1ccnc(C)c1.Cc1ccncc1.
What is the InChIKey of 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine?
The InChIKey is KCMQMIPRNAZZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N.C6H7N.C6H8O.C6H6S/c1-6-3-4-8-7(2)5-6;1-6-2-4-7-5-3-6;2*1-2-6-4-3-5-7-6/h3-5H,1-2H3;2-5H,1H3;3-5H,2H2,1H3;2-5H,1H2.
What are the key properties of 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine?
2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine has a molecular weight of 406.60 g/mol, XLogP of 7.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpyridine;2-ethenylthiophene;2-ethylfuran;4-methylpyridine is sourced from PubChem (CID 159094566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).