4-chloro-2-cyclopropyl-7-ethenylquinoline

C14H12ClN — CID 129029227

IUPAC4-chloro-2-cyclopropyl-7-ethenylquinoline
SMILESC=Cc1ccc2c(Cl)cc(C3CC3)nc2c1
InChIInChI=1S/C14H12ClN/c1-2-9-3-6-11-12(15)8-13(10-4-5-10)16-14(11)7-9/h2-3,6-8,10H,1,4-5H2
InChIKeySETDKRDQOATSGZ-UHFFFAOYSA-N
MW229.71 g/mol
LogP4.41
Rot. Bonds2

About 4-chloro-2-cyclopropyl-7-ethenylquinoline

4-chloro-2-cyclopropyl-7-ethenylquinoline (PubChem CID 129029227) has the molecular formula C14H12ClN and a molecular weight of 229.71 g/mol. Its IUPAC name is 4-chloro-2-cyclopropyl-7-ethenylquinoline.

Molecular Properties

Compound Name4-chloro-2-cyclopropyl-7-ethenylquinoline
PubChem CID129029227
Molecular FormulaC14H12ClN
Molecular Weight229.71 g/mol
Exact Mass229.07
IUPAC Name4-chloro-2-cyclopropyl-7-ethenylquinoline
SMILESC=Cc1ccc2c(Cl)cc(C3CC3)nc2c1
InChIInChI=1S/C14H12ClN/c1-2-9-3-6-11-12(15)8-13(10-4-5-10)16-14(11)7-9/h2-3,6-8,10H,1,4-5H2
InChIKeySETDKRDQOATSGZ-UHFFFAOYSA-N
XLogP4.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-2-cyclopropylquinoline
CID 63357870
4-(4-chloro-7-ethenylquinolin-2-yl)aniline
CID 145292607
4-chloro-7-ethenyl-2-(1H-pyrrol-3-yl)quinoline
CID 145292318
4-chloro-2-(3,5-difluoro-4-methylphenyl)-7-ethenylquinoline
CID 145292580
N-[(1E)-2-(4-chloro-7-ethenylquinolin-2-yl)buta-1,3-dienyl]-N-methylcyclopentanamine
CID 129028952
N-[1-[4-(4-chloro-7-ethenylquinolin-2-yl)-2-fluorophenyl]ethenyl]cyclopropanamine
CID 129029252
5-(4-chloro-7-ethenylquinolin-2-yl)-3-ethenyl-N,N-dimethylpyridin-2-amine
CID 129029246
4-chloro-2-cyclopropyl-6-phenoxyquinoline
CID 63408910
4-chloro-7-ethenyl-2-[4-(1-pyrrolidin-1-ylethyl)phenyl]quinoline
CID 145292266
9-chloro-6-ethenyl-1,2,3,4-tetrahydroacridin-2-amine
CID 145292701
6-ethenyl-2-(oxan-4-yl)quinoline
CID 170708021
1-[(1E)-2-(4-chloro-7-ethenylquinolin-2-yl)buta-1,3-dienyl]-1-methylhydrazine
CID 145292511

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-cyclopropyl-7-ethenylquinoline?
The IUPAC name of 4-chloro-2-cyclopropyl-7-ethenylquinoline (CID 129029227) is 4-chloro-2-cyclopropyl-7-ethenylquinoline.
What is the SMILES notation for 4-chloro-2-cyclopropyl-7-ethenylquinoline?
The canonical SMILES for 4-chloro-2-cyclopropyl-7-ethenylquinoline is C=Cc1ccc2c(Cl)cc(C3CC3)nc2c1.
What is the InChIKey of 4-chloro-2-cyclopropyl-7-ethenylquinoline?
The InChIKey is SETDKRDQOATSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN/c1-2-9-3-6-11-12(15)8-13(10-4-5-10)16-14(11)7-9/h2-3,6-8,10H,1,4-5H2.
What are the key properties of 4-chloro-2-cyclopropyl-7-ethenylquinoline?
4-chloro-2-cyclopropyl-7-ethenylquinoline has a molecular weight of 229.71 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-cyclopropyl-7-ethenylquinoline is sourced from PubChem (CID 129029227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).