(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol

C15H15FN2O — CID 105111410

IUPAC(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
SMILESOC(c1cncc(F)c1)C1CCCc2cccnc21
InChIInChI=1S/C15H15FN2O/c16-12-7-11(8-17-9-12)15(19)13-5-1-3-10-4-2-6-18-14(10)13/h2,4,6-9,13,15,19H,1,3,5H2
InChIKeyYRYQTQADYYXMRD-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.77
Rot. Bonds2

About (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol

(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol (PubChem CID 105111410) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
PubChem CID105111410
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC Name(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
SMILESOC(c1cncc(F)c1)C1CCCc2cccnc21
InChIInChI=1S/C15H15FN2O/c16-12-7-11(8-17-9-12)15(19)13-5-1-3-10-4-2-6-18-14(10)13/h2,4,6-9,13,15,19H,1,3,5H2
InChIKeyYRYQTQADYYXMRD-UHFFFAOYSA-N
XLogP2.77
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79739489
(2,6-difluorophenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79739199
(3-aminophenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 106695855
(3-fluoro-4-methoxyphenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79723755
4-[hydroxy(5,6,7,8-tetrahydroquinolin-8-yl)methyl]benzonitrile
CID 115481009
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3,4,5-trifluorophenyl)methanol
CID 79739398
(3-chloro-4-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 105111318
1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79739208
(3-ethoxyphenyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79721633
pyridin-3-yl(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79748903
[4-(methoxymethyl)phenyl]-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79723636
pyrazolo[1,5-a]pyrazin-3-yl(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 103129014

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol?
The IUPAC name of (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol (CID 105111410) is (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol is OC(c1cncc(F)c1)C1CCCc2cccnc21.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol?
The InChIKey is YRYQTQADYYXMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c16-12-7-11(8-17-9-12)15(19)13-5-1-3-10-4-2-6-18-14(10)13/h2,4,6-9,13,15,19H,1,3,5H2.
What are the key properties of (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol?
(5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol has a molecular weight of 258.30 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol is sourced from PubChem (CID 105111410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).