5-chloro-3-phenylquinoline

C15H10ClN — CID 102190493

IUPAC5-chloro-3-phenylquinoline
SMILESClc1cccc2ncc(-c3ccccc3)cc12
InChIInChI=1S/C15H10ClN/c16-14-7-4-8-15-13(14)9-12(10-17-15)11-5-2-1-3-6-11/h1-10H
InChIKeyFDKMPSCHDZHCEL-UHFFFAOYSA-N
MW239.71 g/mol
LogP4.56
Rot. Bonds1

About 5-chloro-3-phenylquinoline

5-chloro-3-phenylquinoline (PubChem CID 102190493) has the molecular formula C15H10ClN and a molecular weight of 239.71 g/mol. Its IUPAC name is 5-chloro-3-phenylquinoline.

Molecular Properties

Compound Name5-chloro-3-phenylquinoline
PubChem CID102190493
Molecular FormulaC15H10ClN
Molecular Weight239.71 g/mol
Exact Mass239.05
IUPAC Name5-chloro-3-phenylquinoline
SMILESClc1cccc2ncc(-c3ccccc3)cc12
InChIInChI=1S/C15H10ClN/c16-14-7-4-8-15-13(14)9-12(10-17-15)11-5-2-1-3-6-11/h1-10H
InChIKeyFDKMPSCHDZHCEL-UHFFFAOYSA-N
XLogP4.56
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-phenylquinoline?
The IUPAC name of 5-chloro-3-phenylquinoline (CID 102190493) is 5-chloro-3-phenylquinoline.
What is the SMILES notation for 5-chloro-3-phenylquinoline?
The canonical SMILES for 5-chloro-3-phenylquinoline is Clc1cccc2ncc(-c3ccccc3)cc12.
What is the InChIKey of 5-chloro-3-phenylquinoline?
The InChIKey is FDKMPSCHDZHCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN/c16-14-7-4-8-15-13(14)9-12(10-17-15)11-5-2-1-3-6-11/h1-10H.
What are the key properties of 5-chloro-3-phenylquinoline?
5-chloro-3-phenylquinoline has a molecular weight of 239.71 g/mol, XLogP of 4.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-phenylquinoline is sourced from PubChem (CID 102190493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).