(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline

C10H12FN — CID 853159

IUPAC(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESC[C@@H]1CCc2cc(F)ccc2N1
InChIInChI=1S/C10H12FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h4-7,12H,2-3H2,1H3/t7-/m1/s1
InChIKeyBDCCXYVTXRUGAN-SSDOTTSWSA-N
MW165.21 g/mol
LogP2.57
Rot. Bonds

About (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline

(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 853159) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID853159
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESC[C@@H]1CCc2cc(F)ccc2N1
InChIInChI=1S/C10H12FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h4-7,12H,2-3H2,1H3/t7-/m1/s1
InChIKeyBDCCXYVTXRUGAN-SSDOTTSWSA-N
XLogP2.57
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 ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline (CID 853159) is (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline is C[C@@H]1CCc2cc(F)ccc2N1.
What is the InChIKey of (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is BDCCXYVTXRUGAN-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12FN/c1-7-2-3-8-6-9(11)4-5-10(8)12-7/h4-7,12H,2-3H2,1H3/t7-/m1/s1.
What are the key properties of (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline?
(2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 165.21 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 853159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).