6-chloro-2-(fluoromethyl)quinoline

C10H7ClFN — CID 162400997

IUPAC6-chloro-2-(fluoromethyl)quinoline
SMILESFCc1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C10H7ClFN/c11-8-2-4-10-7(5-8)1-3-9(6-12)13-10/h1-5H,6H2
InChIKeySXGNGASHFNUUCC-UHFFFAOYSA-N
MW195.62 g/mol
LogP3.36
Rot. Bonds1

About 6-chloro-2-(fluoromethyl)quinoline

6-chloro-2-(fluoromethyl)quinoline (PubChem CID 162400997) has the molecular formula C10H7ClFN and a molecular weight of 195.62 g/mol. Its IUPAC name is 6-chloro-2-(fluoromethyl)quinoline.

Molecular Properties

Compound Name6-chloro-2-(fluoromethyl)quinoline
PubChem CID162400997
Molecular FormulaC10H7ClFN
Molecular Weight195.62 g/mol
Exact Mass195.03
IUPAC Name6-chloro-2-(fluoromethyl)quinoline
SMILESFCc1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C10H7ClFN/c11-8-2-4-10-7(5-8)1-3-9(6-12)13-10/h1-5H,6H2
InChIKeySXGNGASHFNUUCC-UHFFFAOYSA-N
XLogP3.36
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.62
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(6-chloroquinolin-2-yl)-N,N-dimethylacetamide
CID 110490467
3-(6-chloroquinolin-2-yl)-2-methylpropanoic acid
CID 82244797
3-[(6-chloroquinolin-2-yl)methyl-methylamino]propane-1,2-diol
CID 77080268
(2S)-3-[(6-chloroquinolin-2-yl)methyl-methylamino]propane-1,2-diol
CID 99928103
N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 91774737
2-(bromomethyl)-7-chloroquinoline
CID 10244160
6-chloro-2-[[(1R,5S)-8-methoxy-3-azabicyclo[3.2.1]octan-3-yl]methyl]quinoline
CID 74247744
N-[(6-chloroquinolin-2-yl)methyl]-N-methyl-1-(oxan-2-yl)methanamine
CID 77080814
CID 164677477
CID 164677477
4-amino-N-[(6-chloroquinolin-2-yl)methyl]cyclohexane-1-carboxamide
CID 166158842
[5-chloro-2-(quinolin-2-ylmethyl)phenyl]methanamine
CID 66159539
6-chloro-2-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]quinoline
CID 118588324

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(fluoromethyl)quinoline?
The IUPAC name of 6-chloro-2-(fluoromethyl)quinoline (CID 162400997) is 6-chloro-2-(fluoromethyl)quinoline.
What is the SMILES notation for 6-chloro-2-(fluoromethyl)quinoline?
The canonical SMILES for 6-chloro-2-(fluoromethyl)quinoline is FCc1ccc2cc(Cl)ccc2n1.
What is the InChIKey of 6-chloro-2-(fluoromethyl)quinoline?
The InChIKey is SXGNGASHFNUUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFN/c11-8-2-4-10-7(5-8)1-3-9(6-12)13-10/h1-5H,6H2.
What are the key properties of 6-chloro-2-(fluoromethyl)quinoline?
6-chloro-2-(fluoromethyl)quinoline has a molecular weight of 195.62 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(fluoromethyl)quinoline is sourced from PubChem (CID 162400997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).