4-chloro-7-[(4-fluorophenyl)methoxy]quinoline

C16H11ClFNO — CID 78324293

IUPAC4-chloro-7-[(4-fluorophenyl)methoxy]quinoline
SMILESFc1ccc(COc2ccc3c(Cl)ccnc3c2)cc1
InChIInChI=1S/C16H11ClFNO/c17-15-7-8-19-16-9-13(5-6-14(15)16)20-10-11-1-3-12(18)4-2-11/h1-9H,10H2
InChIKeyVXZBGBPLZJMOHD-UHFFFAOYSA-N
MW287.72 g/mol
LogP4.61
Rot. Bonds3

About 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline

4-chloro-7-[(4-fluorophenyl)methoxy]quinoline (PubChem CID 78324293) has the molecular formula C16H11ClFNO and a molecular weight of 287.72 g/mol. Its IUPAC name is 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline.

Molecular Properties

Compound Name4-chloro-7-[(4-fluorophenyl)methoxy]quinoline
PubChem CID78324293
Molecular FormulaC16H11ClFNO
Molecular Weight287.72 g/mol
Exact Mass287.05
IUPAC Name4-chloro-7-[(4-fluorophenyl)methoxy]quinoline
SMILESFc1ccc(COc2ccc3c(Cl)ccnc3c2)cc1
InChIInChI=1S/C16H11ClFNO/c17-15-7-8-19-16-9-13(5-6-14(15)16)20-10-11-1-3-12(18)4-2-11/h1-9H,10H2
InChIKeyVXZBGBPLZJMOHD-UHFFFAOYSA-N
XLogP4.61
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.72
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline?
The IUPAC name of 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline (CID 78324293) is 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline.
What is the SMILES notation for 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline?
The canonical SMILES for 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline is Fc1ccc(COc2ccc3c(Cl)ccnc3c2)cc1.
What is the InChIKey of 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline?
The InChIKey is VXZBGBPLZJMOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClFNO/c17-15-7-8-19-16-9-13(5-6-14(15)16)20-10-11-1-3-12(18)4-2-11/h1-9H,10H2.
What are the key properties of 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline?
4-chloro-7-[(4-fluorophenyl)methoxy]quinoline has a molecular weight of 287.72 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-[(4-fluorophenyl)methoxy]quinoline is sourced from PubChem (CID 78324293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).