8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline

C14H12F2N2O — CID 112676286

IUPAC8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
SMILESFc1cnc(Oc2cccc3c2NCCC3)c(F)c1
InChIInChI=1S/C14H12F2N2O/c15-10-7-11(16)14(18-8-10)19-12-5-1-3-9-4-2-6-17-13(9)12/h1,3,5,7-8,17H,2,4,6H2
InChIKeyPBXPAOTZVCVGHY-UHFFFAOYSA-N
MW262.26 g/mol
LogP3.51
Rot. Bonds2

About 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline

8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline (PubChem CID 112676286) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
PubChem CID112676286
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
SMILESFc1cnc(Oc2cccc3c2NCCC3)c(F)c1
InChIInChI=1S/C14H12F2N2O/c15-10-7-11(16)14(18-8-10)19-12-5-1-3-9-4-2-6-17-13(9)12/h1,3,5,7-8,17H,2,4,6H2
InChIKeyPBXPAOTZVCVGHY-UHFFFAOYSA-N
XLogP3.51
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline with MolForge

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Related Compounds

8-[(5-fluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 61313548
8-[(5-bromo-3-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 103582950
8-[(3-methyl-5-nitro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 62475365
8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 54907879
3,5-difluoro-4-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzonitrile
CID 81285817
8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
CID 61025631
8-[(5-tert-butyl-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 107875268
8-pyridin-4-yloxy-1,2,3,4-tetrahydroquinoline
CID 54908431
2-fluoro-6-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzonitrile
CID 61026238
8-(2-methylpyrimidin-4-yl)oxy-1,2,3,4-tetrahydroquinoline
CID 62770238
8-[(3-methylsulfonyl-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 114599393
8-[(5-fluoro-2-methoxyphenyl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 61027694

Frequently Asked Questions

What is the IUPAC name of 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline (CID 112676286) is 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline is Fc1cnc(Oc2cccc3c2NCCC3)c(F)c1.
What is the InChIKey of 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
The InChIKey is PBXPAOTZVCVGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c15-10-7-11(16)14(18-8-10)19-12-5-1-3-9-4-2-6-17-13(9)12/h1,3,5,7-8,17H,2,4,6H2.
What are the key properties of 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline?
8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline has a molecular weight of 262.26 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 112676286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).