2-fluoroquinoline;methane

C10H10FN — CID 156751124

IUPAC2-fluoroquinoline;methane
SMILESC.Fc1ccc2ccccc2n1
InChIInChI=1S/C9H6FN.CH4/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H;1H4
InChIKeyZADBTLOUSYJCOF-UHFFFAOYSA-N
MW163.19 g/mol
LogP3.01
Rot. Bonds

About 2-fluoroquinoline;methane

2-fluoroquinoline;methane (PubChem CID 156751124) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 2-fluoroquinoline;methane.

Molecular Properties

Compound Name2-fluoroquinoline;methane
PubChem CID156751124
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name2-fluoroquinoline;methane
SMILESC.Fc1ccc2ccccc2n1
InChIInChI=1S/C9H6FN.CH4/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H;1H4
InChIKeyZADBTLOUSYJCOF-UHFFFAOYSA-N
XLogP3.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

quinolin-2-amine;zirconium
CID 175251209
ethane;methane;2-methylquinoline
CID 144748871
acridine;methane
CID 21324126
2-(2-fluorophenyl)quinoline
CID 11622684
quinolin-2-yl hypofluorite
CID 141219202
N,N-dibromoquinolin-2-amine;dihydrate
CID 174663380
2-iodoquinoline
CID 159061150
ethane;2-methylsulfanylquinoline
CID 123701465
2-tert-butylquinoline;methane
CID 164995315
methane;2-propan-2-ylquinoline
CID 161334581
silver quinolin-2-olate
CID 162166701
CID 158897445
CID 158897445

Frequently Asked Questions

What is the IUPAC name of 2-fluoroquinoline;methane?
The IUPAC name of 2-fluoroquinoline;methane (CID 156751124) is 2-fluoroquinoline;methane.
What is the SMILES notation for 2-fluoroquinoline;methane?
The canonical SMILES for 2-fluoroquinoline;methane is C.Fc1ccc2ccccc2n1.
What is the InChIKey of 2-fluoroquinoline;methane?
The InChIKey is ZADBTLOUSYJCOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6FN.CH4/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H;1H4.
What are the key properties of 2-fluoroquinoline;methane?
2-fluoroquinoline;methane has a molecular weight of 163.19 g/mol, XLogP of 3.01, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroquinoline;methane is sourced from PubChem (CID 156751124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).