2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol

C25H21FN2O — CID 59342047

IUPAC2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol
SMILESCC(C)(c1cc(F)cc(-c2cccc(-c3ccccn3)n2)c1)c1ccccc1O
InChIInChI=1S/C25H21FN2O/c1-25(2,20-8-3-4-12-24(20)29)18-14-17(15-19(26)16-18)21-10-7-11-23(28-21)22-9-5-6-13-27-22/h3-16,29H,1-2H3
InChIKeyVVIPBYZWQMTNJY-UHFFFAOYSA-N
MW384.45 g/mol
LogP5.98
Rot. Bonds4

About 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol

2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol (PubChem CID 59342047) has the molecular formula C25H21FN2O and a molecular weight of 384.45 g/mol. Its IUPAC name is 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol.

Molecular Properties

Compound Name2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol
PubChem CID59342047
Molecular FormulaC25H21FN2O
Molecular Weight384.45 g/mol
Exact Mass384.16
IUPAC Name2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol
SMILESCC(C)(c1cc(F)cc(-c2cccc(-c3ccccn3)n2)c1)c1ccccc1O
InChIInChI=1S/C25H21FN2O/c1-25(2,20-8-3-4-12-24(20)29)18-14-17(15-19(26)16-18)21-10-7-11-23(28-21)22-9-5-6-13-27-22/h3-16,29H,1-2H3
InChIKeyVVIPBYZWQMTNJY-UHFFFAOYSA-N
XLogP5.98
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.45
LogP ≤ 55.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
NoName_714
CID 135489221
3-Fluoro-4''-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
CID 46854606
2,6-Difluoro-4-[4-[4-(4-methylpiperazin-1-yl)phenyl]pyridin-3-yl]phenol
CID 73010393
Alpha-(2-pyridylmethylene)-O-cresol
CID 642844
2-Fluoro-4-[5-(pyridin-4-yl)-7,8-dihydronaphthalen-2-yl]phenol
CID 25033805
4-Methyl-2-[(quinolin-3-ylamino)methyl]phenol
CID 951116
2,6-Bis(tert-butyl)-4-(morpholin-4-yl-2-pyridylmethyl)phenol
CID 4016538
2,6-Di-tert-butyl-4-(2-(3-pyridinyl)ethenyl)phenol
CID 6439912
3-[(7R,8R,9aR)-7,8-dimethyl-2-(quinolin-4-ylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol
CID 16094382
3-[(7R,8R,9aR)-7,8-dimethyl-2-(pyridin-2-ylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol
CID 16094383
3-[(7R,8R,9aR)-7,8-dimethyl-2-(pyridin-3-ylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol
CID 16094384

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol?
The IUPAC name of 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol (CID 59342047) is 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol.
What is the SMILES notation for 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol?
The canonical SMILES for 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol is CC(C)(c1cc(F)cc(-c2cccc(-c3ccccn3)n2)c1)c1ccccc1O.
What is the InChIKey of 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol?
The InChIKey is VVIPBYZWQMTNJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21FN2O/c1-25(2,20-8-3-4-12-24(20)29)18-14-17(15-19(26)16-18)21-10-7-11-23(28-21)22-9-5-6-13-27-22/h3-16,29H,1-2H3.
What are the key properties of 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol?
2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol has a molecular weight of 384.45 g/mol, XLogP of 5.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-fluoro-5-(6-pyridin-2-yl-2-pyridinyl)phenyl]propan-2-yl]phenol is sourced from PubChem (CID 59342047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).