6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline

C11H16FN — CID 57130142

IUPAC6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline
SMILESCC1CC=C2CC(C)(F)CCC2=N1
InChIInChI=1S/C11H16FN/c1-8-3-4-9-7-11(2,12)6-5-10(9)13-8/h4,8H,3,5-7H2,1-2H3
InChIKeyFQLDNJQRYZBZCU-UHFFFAOYSA-N
MW181.25 g/mol
LogP3.06
Rot. Bonds

About 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline

6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline (PubChem CID 57130142) has the molecular formula C11H16FN and a molecular weight of 181.25 g/mol. Its IUPAC name is 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline.

Molecular Properties

Compound Name6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline
PubChem CID57130142
Molecular FormulaC11H16FN
Molecular Weight181.25 g/mol
Exact Mass181.13
IUPAC Name6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline
SMILESCC1CC=C2CC(C)(F)CCC2=N1
InChIInChI=1S/C11H16FN/c1-8-3-4-9-7-11(2,12)6-5-10(9)13-8/h4,8H,3,5-7H2,1-2H3
InChIKeyFQLDNJQRYZBZCU-UHFFFAOYSA-N
XLogP3.06
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.25
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,5,5-trimethyl-N-(2,2,2-trifluoroethyl)cyclohex-2-en-1-imine
CID 70518262
2-Ethyl-6-fluoro-4a,5,8,8a-tetrahydroquinoline
CID 130413096
(5S,8R)-5-fluoro-8-methyl-2,3,5,6,7,8-hexahydroquinoline
CID 170294076
(5S)-5-fluoro-5-methyl-3,6,7,8-tetrahydro-2H-quinoline
CID 170296705
(5S)-5-fluoro-2,3,5,6,7,8-hexahydroquinoline
CID 174141813
N-methyl-4,4a,5,6,7,8-hexahydro-3H-naphthalen-2-imine
CID 123443471
6-Butan-2-yl-5-ethyl-3-methyl-2,3-dihydropyridine
CID 123847631
2-Propan-2-yl-4a,5,6,7,8,8a-hexahydroquinoline
CID 134228469
(2Z)-2-ethylidene-N,4-dimethylcyclohexan-1-imine
CID 134353036
Ethane;8-ethyl-2,3,5,6,7,8-hexahydroquinoline
CID 144281403
(2Z)-2-ethylidene-N,5-dimethylcyclohexan-1-imine
CID 146364261
8-Methyl-2,3,5,6,7,8-hexahydroquinoline
CID 167264804

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline?
The IUPAC name of 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline (CID 57130142) is 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline.
What is the SMILES notation for 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline?
The canonical SMILES for 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline is CC1CC=C2CC(C)(F)CCC2=N1.
What is the InChIKey of 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline?
The InChIKey is FQLDNJQRYZBZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN/c1-8-3-4-9-7-11(2,12)6-5-10(9)13-8/h4,8H,3,5-7H2,1-2H3.
What are the key properties of 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline?
6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline has a molecular weight of 181.25 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2,6-dimethyl-3,5,7,8-tetrahydro-2H-quinoline is sourced from PubChem (CID 57130142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).