7-fluoro-4-iodoquinoline

C9H5FIN — CID 118066569

IUPAC7-fluoro-4-iodoquinoline
SMILESFc1ccc2c(I)ccnc2c1
InChIInChI=1S/C9H5FIN/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H
InChIKeyGNOWOPZTFSURHQ-UHFFFAOYSA-N
MW273.05 g/mol
LogP2.98
Rot. Bonds

About 7-fluoro-4-iodoquinoline

7-fluoro-4-iodoquinoline (PubChem CID 118066569) has the molecular formula C9H5FIN and a molecular weight of 273.05 g/mol. Its IUPAC name is 7-fluoro-4-iodoquinoline.

Molecular Properties

Compound Name7-fluoro-4-iodoquinoline
PubChem CID118066569
Molecular FormulaC9H5FIN
Molecular Weight273.05 g/mol
Exact Mass272.95
IUPAC Name7-fluoro-4-iodoquinoline
SMILESFc1ccc2c(I)ccnc2c1
InChIInChI=1S/C9H5FIN/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H
InChIKeyGNOWOPZTFSURHQ-UHFFFAOYSA-N
XLogP2.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.05
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

ethane;7-fluoro-4-methylquinoline
CID 142037193
7-fluoroquinoline-4-carboxylic acid
CID 18475507
7-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline
CID 123938422
7-fluoroquinoline-4-carboximidamide
CID 83677826
N-(4-chlorophenyl)-7-fluoroquinolin-4-amine
CID 71468200
N-(2-chloro-4-fluorophenyl)-7-iodoquinolin-4-amine
CID 44532440
2-[(7-fluoroquinolin-4-yl)amino]acetic acid
CID 83837512
2-(7-fluoroquinolin-4-yl)sulfanylacetic acid
CID 54773018
1-(2,4-difluorophenyl)-4-iodopyrazolo[3,4-b]pyridine
CID 66664844
2-fluoro-3-hydroperoxy-4-iodopyridine
CID 163928506
4-[(7-fluoroquinolin-4-yl)amino]benzoic acid
CID 54773030
N-(2-cyclopropylethyl)-7-fluoroquinolin-4-amine
CID 133324339

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-iodoquinoline?
The IUPAC name of 7-fluoro-4-iodoquinoline (CID 118066569) is 7-fluoro-4-iodoquinoline.
What is the SMILES notation for 7-fluoro-4-iodoquinoline?
The canonical SMILES for 7-fluoro-4-iodoquinoline is Fc1ccc2c(I)ccnc2c1.
What is the InChIKey of 7-fluoro-4-iodoquinoline?
The InChIKey is GNOWOPZTFSURHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5FIN/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H.
What are the key properties of 7-fluoro-4-iodoquinoline?
7-fluoro-4-iodoquinoline has a molecular weight of 273.05 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-iodoquinoline is sourced from PubChem (CID 118066569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).