4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline

C19H16ClN — CID 145292362

IUPAC4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline
SMILESC=Cc1ccc2c(Cl)c(C)c(-c3ccc(C)cc3)nc2c1
InChIInChI=1S/C19H16ClN/c1-4-14-7-10-16-17(11-14)21-19(13(3)18(16)20)15-8-5-12(2)6-9-15/h4-11H,1H2,2-3H3
InChIKeyXEFWKFFCVHHZAB-UHFFFAOYSA-N
MW293.80 g/mol
LogP5.82
Rot. Bonds2

About 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline

4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline (PubChem CID 145292362) has the molecular formula C19H16ClN and a molecular weight of 293.80 g/mol. Its IUPAC name is 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline.

Molecular Properties

Compound Name4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline
PubChem CID145292362
Molecular FormulaC19H16ClN
Molecular Weight293.80 g/mol
Exact Mass293.10
IUPAC Name4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline
SMILESC=Cc1ccc2c(Cl)c(C)c(-c3ccc(C)cc3)nc2c1
InChIInChI=1S/C19H16ClN/c1-4-14-7-10-16-17(11-14)21-19(13(3)18(16)20)15-8-5-12(2)6-9-15/h4-11H,1H2,2-3H3
InChIKeyXEFWKFFCVHHZAB-UHFFFAOYSA-N
XLogP5.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.80
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-2-(3,5-difluoro-4-methylphenyl)-7-ethenylquinoline
CID 145292580
4-(4-chloro-7-ethenylquinolin-2-yl)aniline
CID 145292607
1-(4-ethenylphenyl)-4-(4-methylphenyl)benzene
CID 123748481
6-chloro-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid
CID 4712139
CID 174976037
CID 174976037
1-ethenyl-4-methylbenzene;methane
CID 142136023
4-chloro-7-ethenyl-2-(1H-pyrrol-3-yl)quinoline
CID 145292318
4-chloro-2-cyclopropyl-7-ethenylquinoline
CID 129029227
9-chloro-6-ethenyl-1,2,3,4-tetrahydroacridin-2-amine
CID 145292701
anthracene;1-ethenyl-4-methylbenzene
CID 174555561
4-chloro-7-ethenyl-2-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)quinoline
CID 129029224
1-ethenyl-4-methylbenzene;methanamine
CID 23466173

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline?
The IUPAC name of 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline (CID 145292362) is 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline.
What is the SMILES notation for 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline?
The canonical SMILES for 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline is C=Cc1ccc2c(Cl)c(C)c(-c3ccc(C)cc3)nc2c1.
What is the InChIKey of 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline?
The InChIKey is XEFWKFFCVHHZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN/c1-4-14-7-10-16-17(11-14)21-19(13(3)18(16)20)15-8-5-12(2)6-9-15/h4-11H,1H2,2-3H3.
What are the key properties of 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline?
4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline has a molecular weight of 293.80 g/mol, XLogP of 5.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-ethenyl-3-methyl-2-(4-methylphenyl)quinoline is sourced from PubChem (CID 145292362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).