6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline

C11H14FN — CID 84618460

IUPAC6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CNc2ccc(F)cc2C1C
InChIInChI=1S/C11H14FN/c1-7-6-13-11-4-3-9(12)5-10(11)8(7)2/h3-5,7-8,13H,6H2,1-2H3
InChIKeyHUSLFYFYYVLQMM-UHFFFAOYSA-N
MW179.24 g/mol
LogP2.99
Rot. Bonds

About 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline

6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline (PubChem CID 84618460) has the molecular formula C11H14FN and a molecular weight of 179.24 g/mol. Its IUPAC name is 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline
PubChem CID84618460
Molecular FormulaC11H14FN
Molecular Weight179.24 g/mol
Exact Mass179.11
IUPAC Name6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CNc2ccc(F)cc2C1C
InChIInChI=1S/C11H14FN/c1-7-6-13-11-4-3-9(12)5-10(11)8(7)2/h3-5,7-8,13H,6H2,1-2H3
InChIKeyHUSLFYFYYVLQMM-UHFFFAOYSA-N
XLogP2.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-5-fluoro-2,3-dimethyl-2,3-dihydro-1H-indole
CID 170593238
5-fluoro-2,3-dihydro-1H-indol-3-amine
CID 84739506
4-(6-fluoro-3-methyl-1,2,3,4-tetrahydroquinolin-4-yl)morpholine
CID 82275749
5-fluoro-3-[(5-fluoro-2,3-dihydro-1H-indol-3-yl)methyl]-2,3-dihydro-1H-indole
CID 50902602
3-(1,1-difluoroethyl)-5-fluoro-2,3-dihydro-1H-indole
CID 84669875
5-fluoro-3-propyl-2,3-dihydro-1H-indole
CID 70323615
3-(1-cyclohexylethyl)-5-fluoro-2,3-dihydro-1H-indole
CID 106985960
4,6-difluoro-1,2,3,4-tetrahydroquinoline
CID 83853904
5-fluoro-3-(4-methylpentan-2-yl)-2,3-dihydro-1H-indole
CID 106985857
O-[(5-fluoro-2,3-dihydro-1H-indol-3-yl)methyl]hydroxylamine
CID 117202128
2-(5-fluoro-2,3-dihydro-1H-indol-3-yl)-N,N-dimethylethanamine;molecular hydrogen
CID 166138415
6-fluoro-4-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline
CID 105460978

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline (CID 84618460) is 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline is CC1CNc2ccc(F)cc2C1C.
What is the InChIKey of 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is HUSLFYFYYVLQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN/c1-7-6-13-11-4-3-9(12)5-10(11)8(7)2/h3-5,7-8,13H,6H2,1-2H3.
What are the key properties of 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline?
6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 179.24 g/mol, XLogP of 2.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3,4-dimethyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 84618460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).