6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline

C16H16FN — CID 62500792

IUPAC6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc(F)c(-c2ccc3c(c2)CCCN3)c1
InChIInChI=1S/C16H16FN/c1-11-4-6-15(17)14(9-11)12-5-7-16-13(10-12)3-2-8-18-16/h4-7,9-10,18H,2-3,8H2,1H3
InChIKeyGXZPMYAFNYLUJG-UHFFFAOYSA-N
MW241.31 g/mol
LogP4.16
Rot. Bonds1

About 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline

6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 62500792) has the molecular formula C16H16FN and a molecular weight of 241.31 g/mol. Its IUPAC name is 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID62500792
Molecular FormulaC16H16FN
Molecular Weight241.31 g/mol
Exact Mass241.13
IUPAC Name6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc(F)c(-c2ccc3c(c2)CCCN3)c1
InChIInChI=1S/C16H16FN/c1-11-4-6-15(17)14(9-11)12-5-7-16-13(10-12)3-2-8-18-16/h4-7,9-10,18H,2-3,8H2,1H3
InChIKeyGXZPMYAFNYLUJG-UHFFFAOYSA-N
XLogP4.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-Methyl-1,2,3,4-tetrahydroquinoline
CID 66678
1,2-Dihydro-2,2,4-trimethyl-6-phenylquinoline
CID 77098
Acridan
CID 7106
1,2,3,4-Tetrahydroquinoline
CID 69460
Despropionyl meta-fluorofentanyl
CID 23741730
9,9-Dimethyl-9,10-dihydroacridine
CID 22647
1,2,3,4-Tetrahydro-4-methylquinoline
CID 86854
2-Methyl-1,2,3,4-tetrahydroquinoline
CID 96289
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
CID 110640
6,6'-Methylenebis(1,2-dihydro-2,2,4-trimethylquinoline)
CID 99342
6-(2-Fluorophenyl)-2,2-dimethyl-4-[(prop-2-en-1-ylsulfanyl)methyl]-1,2-dihydroquinoline
CID 10337273
Monometacrine
CID 145765

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline (CID 62500792) is 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline is Cc1ccc(F)c(-c2ccc3c(c2)CCCN3)c1.
What is the InChIKey of 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is GXZPMYAFNYLUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN/c1-11-4-6-15(17)14(9-11)12-5-7-16-13(10-12)3-2-8-18-16/h4-7,9-10,18H,2-3,8H2,1H3.
What are the key properties of 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline?
6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 241.31 g/mol, XLogP of 4.16, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 62500792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).