2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol

C21H18F2N2O2 — CID 118704762

IUPAC2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol
SMILESOc1c(F)cc(-c2cnccc2-c2ccc(N3CCOCC3)cc2)cc1F
InChIInChI=1S/C21H18F2N2O2/c22-19-11-15(12-20(23)21(19)26)18-13-24-6-5-17(18)14-1-3-16(4-2-14)25-7-9-27-10-8-25/h1-6,11-13,26H,7-10H2
InChIKeyYUYJEQHNWKQNBT-UHFFFAOYSA-N
MW368.38 g/mol
LogP4.24
Rot. Bonds3

About 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol

2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol (PubChem CID 118704762) has the molecular formula C21H18F2N2O2 and a molecular weight of 368.38 g/mol. Its IUPAC name is 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol.

Molecular Properties

Compound Name2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol
PubChem CID118704762
Molecular FormulaC21H18F2N2O2
Molecular Weight368.38 g/mol
Exact Mass368.13
IUPAC Name2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol
SMILESOc1c(F)cc(-c2cnccc2-c2ccc(N3CCOCC3)cc2)cc1F
InChIInChI=1S/C21H18F2N2O2/c22-19-11-15(12-20(23)21(19)26)18-13-24-6-5-17(18)14-1-3-16(4-2-14)25-7-9-27-10-8-25/h1-6,11-13,26H,7-10H2
InChIKeyYUYJEQHNWKQNBT-UHFFFAOYSA-N
XLogP4.24
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
3-Fluoro-4''-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
CID 46854606
3-Fluoro-4''-(pyridin-4-ylmethyl)biphenyl-4-ol
CID 46901611
2,6-Difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol
CID 73010393
3-Fluoro-4''-(2-methyl-1-(pyridin-4-yl)prop-1-enyl)biphenyl-4-ol
CID 49799473
Vrk-IN-1
CID 155511407
2,6-Difluoro-4-[4-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-pyridinyl]phenol
CID 117071998
2,6-Difluoro-4-(4-phenyl-3-pyridinyl)phenol
CID 122186015
2,6-Difluoro-4-[4-(oxan-4-yl)-3-pyridinyl]phenol
CID 122186016
2,6-Difluoro-4-[4-(3-methylphenyl)-3-pyridinyl]phenol
CID 122186019
4-[4-[3-(2-Aminoethoxy)phenyl]-3-pyridinyl]-2,6-difluorophenol
CID 122186021
2,6-Difluoro-4-[4-(3-morpholin-4-ylphenyl)-3-pyridinyl]phenol
CID 122186023

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol?
The IUPAC name of 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol (CID 118704762) is 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol.
What is the SMILES notation for 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol?
The canonical SMILES for 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol is Oc1c(F)cc(-c2cnccc2-c2ccc(N3CCOCC3)cc2)cc1F.
What is the InChIKey of 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol?
The InChIKey is YUYJEQHNWKQNBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18F2N2O2/c22-19-11-15(12-20(23)21(19)26)18-13-24-6-5-17(18)14-1-3-16(4-2-14)25-7-9-27-10-8-25/h1-6,11-13,26H,7-10H2.
What are the key properties of 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol?
2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol has a molecular weight of 368.38 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)-3-pyridinyl]phenol is sourced from PubChem (CID 118704762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).