8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline

C10H12FN — CID 16792731

IUPAC8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(F)c2c(c1)CCCN2
InChIInChI=1S/C10H12FN/c1-7-5-8-3-2-4-12-10(8)9(11)6-7/h5-6,12H,2-4H2,1H3
InChIKeyYALAGFGALCWJBV-UHFFFAOYSA-N
MW165.21 g/mol
LogP2.49
Rot. Bonds

About 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline

8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 16792731) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID16792731
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(F)c2c(c1)CCCN2
InChIInChI=1S/C10H12FN/c1-7-5-8-3-2-4-12-10(8)9(11)6-7/h5-6,12H,2-4H2,1H3
InChIKeyYALAGFGALCWJBV-UHFFFAOYSA-N
XLogP2.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline (CID 16792731) is 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline is Cc1cc(F)c2c(c1)CCCN2.
What is the InChIKey of 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is YALAGFGALCWJBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN/c1-7-5-8-3-2-4-12-10(8)9(11)6-7/h5-6,12H,2-4H2,1H3.
What are the key properties of 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline?
8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 165.21 g/mol, XLogP of 2.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-6-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 16792731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).