4-chloro-3-ethenyl-2-methylquinoline

C12H10ClN — CID 58125410

IUPAC4-chloro-3-ethenyl-2-methylquinoline
SMILESC=Cc1c(C)nc2ccccc2c1Cl
InChIInChI=1S/C12H10ClN/c1-3-9-8(2)14-11-7-5-4-6-10(11)12(9)13/h3-7H,1H2,2H3
InChIKeyVOPLXJGGABDVJP-UHFFFAOYSA-N
MW203.67 g/mol
LogP3.84
Rot. Bonds1

About 4-chloro-3-ethenyl-2-methylquinoline

4-chloro-3-ethenyl-2-methylquinoline (PubChem CID 58125410) has the molecular formula C12H10ClN and a molecular weight of 203.67 g/mol. Its IUPAC name is 4-chloro-3-ethenyl-2-methylquinoline.

Molecular Properties

Compound Name4-chloro-3-ethenyl-2-methylquinoline
PubChem CID58125410
Molecular FormulaC12H10ClN
Molecular Weight203.67 g/mol
Exact Mass203.05
IUPAC Name4-chloro-3-ethenyl-2-methylquinoline
SMILESC=Cc1c(C)nc2ccccc2c1Cl
InChIInChI=1S/C12H10ClN/c1-3-9-8(2)14-11-7-5-4-6-10(11)12(9)13/h3-7H,1H2,2H3
InChIKeyVOPLXJGGABDVJP-UHFFFAOYSA-N
XLogP3.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,4-dichloro-2-methylquinoline;platinum
CID 159361617
1-chloro-2-ethenyl-3-methylnaphthalene
CID 67126076
3-(2-bromophenyl)-4-chloro-2-methylquinoline
CID 164671168
2,4-dichloroquinoline-3-carbaldehyde
CID 14920516
4-chloro-2-methyl-3-nitroquinoline
CID 12673397
4-ethyl-2-methylquinoline-3-carbaldehyde
CID 178074817
1-(2,4-dichloroquinolin-3-yl)-N-phenylmethanimine
CID 2785143
3-chloro-4-ethenyl-2-methyl-6-pyrimidin-5-ylquinoline
CID 150177823
3-hex-1-enyl-2,4-dimethylquinoline
CID 70124767
1-(2,4-dimethylquinolin-3-yl)-N-phenylmethanimine;ethane
CID 157427941
9-ethenyl-10-methylphenanthrene
CID 123648763
3-ethenyl-4-prop-1-en-2-ylquinolin-2-amine
CID 143860568

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-ethenyl-2-methylquinoline?
The IUPAC name of 4-chloro-3-ethenyl-2-methylquinoline (CID 58125410) is 4-chloro-3-ethenyl-2-methylquinoline.
What is the SMILES notation for 4-chloro-3-ethenyl-2-methylquinoline?
The canonical SMILES for 4-chloro-3-ethenyl-2-methylquinoline is C=Cc1c(C)nc2ccccc2c1Cl.
What is the InChIKey of 4-chloro-3-ethenyl-2-methylquinoline?
The InChIKey is VOPLXJGGABDVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN/c1-3-9-8(2)14-11-7-5-4-6-10(11)12(9)13/h3-7H,1H2,2H3.
What are the key properties of 4-chloro-3-ethenyl-2-methylquinoline?
4-chloro-3-ethenyl-2-methylquinoline has a molecular weight of 203.67 g/mol, XLogP of 3.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-ethenyl-2-methylquinoline is sourced from PubChem (CID 58125410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).