4-chloro-2-ethenyl-5-methylpyridine

C8H8ClN — CID 74888934

IUPAC4-chloro-2-ethenyl-5-methylpyridine
SMILESC=Cc1cc(Cl)c(C)cn1
InChIInChI=1S/C8H8ClN/c1-3-7-4-8(9)6(2)5-10-7/h3-5H,1H2,2H3
InChIKeyLSCBPNSFICICOQ-UHFFFAOYSA-N
MW153.61 g/mol
LogP2.69
Rot. Bonds1

About 4-chloro-2-ethenyl-5-methylpyridine

4-chloro-2-ethenyl-5-methylpyridine (PubChem CID 74888934) has the molecular formula C8H8ClN and a molecular weight of 153.61 g/mol. Its IUPAC name is 4-chloro-2-ethenyl-5-methylpyridine.

Molecular Properties

Compound Name4-chloro-2-ethenyl-5-methylpyridine
PubChem CID74888934
Molecular FormulaC8H8ClN
Molecular Weight153.61 g/mol
Exact Mass153.03
IUPAC Name4-chloro-2-ethenyl-5-methylpyridine
SMILESC=Cc1cc(Cl)c(C)cn1
InChIInChI=1S/C8H8ClN/c1-3-7-4-8(9)6(2)5-10-7/h3-5H,1H2,2H3
InChIKeyLSCBPNSFICICOQ-UHFFFAOYSA-N
XLogP2.69
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.61
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-chloro-2-ethenyl-5-methylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-ethenyl-4-methylpyridin-3-amine
CID 74888522
4-chloro-2,5-dimethylpyridine;ethane
CID 176713957
2-ethenyl-5-ethyl-4-methylpyridine
CID 45079614
(6-ethenyl-4-methyl-3-pyridinyl)methanol
CID 171542080
2-chloro-6-ethenyl-3-methylpyridine
CID 74888813
4-chloro-5-methylpyridine-2-carbonitrile
CID 75422082
4-chloro-6-ethenylpyrimidine
CID 118155850
6-ethenylpyridine-3,4-diamine
CID 74891844
2-ethenyl-5-methyl-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine
CID 155344346
azane;4-chloro-6-ethenylpyrimidine
CID 175485359
5-[(3,3-difluoroazetidin-1-yl)methyl]-2-ethenyl-4-methylpyridine;ethane
CID 171542363
4-ethenyl-2-fluoro-5-methylpyridine
CID 74888966

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethenyl-5-methylpyridine?
The IUPAC name of 4-chloro-2-ethenyl-5-methylpyridine (CID 74888934) is 4-chloro-2-ethenyl-5-methylpyridine.
What is the SMILES notation for 4-chloro-2-ethenyl-5-methylpyridine?
The canonical SMILES for 4-chloro-2-ethenyl-5-methylpyridine is C=Cc1cc(Cl)c(C)cn1.
What is the InChIKey of 4-chloro-2-ethenyl-5-methylpyridine?
The InChIKey is LSCBPNSFICICOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN/c1-3-7-4-8(9)6(2)5-10-7/h3-5H,1H2,2H3.
What are the key properties of 4-chloro-2-ethenyl-5-methylpyridine?
4-chloro-2-ethenyl-5-methylpyridine has a molecular weight of 153.61 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethenyl-5-methylpyridine is sourced from PubChem (CID 74888934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).