6-fluoro-2-methyl-8,8a-dihydroquinoline

C10H10FN — CID 130413071

IUPAC6-fluoro-2-methyl-8,8a-dihydroquinoline
SMILESCC1=NC2CC=C(F)C=C2C=C1
InChIInChI=1S/C10H10FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-4,6,10H,5H2,1H3
InChIKeyFGFGPMQTIYOZSH-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.57
Rot. Bonds

About 6-fluoro-2-methyl-8,8a-dihydroquinoline

6-fluoro-2-methyl-8,8a-dihydroquinoline (PubChem CID 130413071) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 6-fluoro-2-methyl-8,8a-dihydroquinoline.

Molecular Properties

Compound Name6-fluoro-2-methyl-8,8a-dihydroquinoline
PubChem CID130413071
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name6-fluoro-2-methyl-8,8a-dihydroquinoline
SMILESCC1=NC2CC=C(F)C=C2C=C1
InChIInChI=1S/C10H10FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-4,6,10H,5H2,1H3
InChIKeyFGFGPMQTIYOZSH-UHFFFAOYSA-N
XLogP2.57
TPSA12.36 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 ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-methyl-8,8a-dihydroquinoline?
The IUPAC name of 6-fluoro-2-methyl-8,8a-dihydroquinoline (CID 130413071) is 6-fluoro-2-methyl-8,8a-dihydroquinoline.
What is the SMILES notation for 6-fluoro-2-methyl-8,8a-dihydroquinoline?
The canonical SMILES for 6-fluoro-2-methyl-8,8a-dihydroquinoline is CC1=NC2CC=C(F)C=C2C=C1.
What is the InChIKey of 6-fluoro-2-methyl-8,8a-dihydroquinoline?
The InChIKey is FGFGPMQTIYOZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h2-4,6,10H,5H2,1H3.
What are the key properties of 6-fluoro-2-methyl-8,8a-dihydroquinoline?
6-fluoro-2-methyl-8,8a-dihydroquinoline has a molecular weight of 163.19 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-methyl-8,8a-dihydroquinoline is sourced from PubChem (CID 130413071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).