2-(2-chloroprop-1-enyl)quinoline

C12H10ClN — CID 173335992

IUPAC2-(2-chloroprop-1-enyl)quinoline
SMILESCC(Cl)=Cc1ccc2ccccc2n1
InChIInChI=1S/C12H10ClN/c1-9(13)8-11-7-6-10-4-2-3-5-12(10)14-11/h2-8H,1H3
InChIKeyILGLGSMYFVMQTP-UHFFFAOYSA-N
MW203.67 g/mol
LogP3.83
Rot. Bonds1

About 2-(2-chloroprop-1-enyl)quinoline

2-(2-chloroprop-1-enyl)quinoline (PubChem CID 173335992) has the molecular formula C12H10ClN and a molecular weight of 203.67 g/mol. Its IUPAC name is 2-(2-chloroprop-1-enyl)quinoline.

Molecular Properties

Compound Name2-(2-chloroprop-1-enyl)quinoline
PubChem CID173335992
Molecular FormulaC12H10ClN
Molecular Weight203.67 g/mol
Exact Mass203.05
IUPAC Name2-(2-chloroprop-1-enyl)quinoline
SMILESCC(Cl)=Cc1ccc2ccccc2n1
InChIInChI=1S/C12H10ClN/c1-9(13)8-11-7-6-10-4-2-3-5-12(10)14-11/h2-8H,1H3
InChIKeyILGLGSMYFVMQTP-UHFFFAOYSA-N
XLogP3.83
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 ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroprop-1-enyl)quinoline?
The IUPAC name of 2-(2-chloroprop-1-enyl)quinoline (CID 173335992) is 2-(2-chloroprop-1-enyl)quinoline.
What is the SMILES notation for 2-(2-chloroprop-1-enyl)quinoline?
The canonical SMILES for 2-(2-chloroprop-1-enyl)quinoline is CC(Cl)=Cc1ccc2ccccc2n1.
What is the InChIKey of 2-(2-chloroprop-1-enyl)quinoline?
The InChIKey is ILGLGSMYFVMQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN/c1-9(13)8-11-7-6-10-4-2-3-5-12(10)14-11/h2-8H,1H3.
What are the key properties of 2-(2-chloroprop-1-enyl)quinoline?
2-(2-chloroprop-1-enyl)quinoline has a molecular weight of 203.67 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroprop-1-enyl)quinoline is sourced from PubChem (CID 173335992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).