pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol

C26H19N5O — CID 102494319

IUPACpyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol
SMILESOC(c1ccccn1)(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C26H19N5O/c32-26(23-13-3-6-18-29-23,24-14-7-11-21(30-24)19-9-1-4-16-27-19)25-15-8-12-22(31-25)20-10-2-5-17-28-20/h1-18,32H
InChIKeyLKNRZRUGYIJCLQ-UHFFFAOYSA-N
MW417.47 g/mol
LogP4.28
Rot. Bonds5

About pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol

pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol (PubChem CID 102494319) has the molecular formula C26H19N5O and a molecular weight of 417.47 g/mol. Its IUPAC name is pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol.

Molecular Properties

Compound Namepyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol
PubChem CID102494319
Molecular FormulaC26H19N5O
Molecular Weight417.47 g/mol
Exact Mass417.16
IUPAC Namepyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol
SMILESOC(c1ccccn1)(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C26H19N5O/c32-26(23-13-3-6-18-29-23,24-14-7-11-21(30-24)19-9-1-4-16-27-19)25-15-8-12-22(31-25)20-10-2-5-17-28-20/h1-18,32H
InChIKeyLKNRZRUGYIJCLQ-UHFFFAOYSA-N
XLogP4.28
TPSA84.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-Benzhydryl-4-(pyridin-2-yl)piperidin-4-ol
CID 10427620
3-Quinuclidinol, 3-(2-pyridyl)-
CID 208598
Tripyridin-2-ylmethanol
CID 4400709
3-(4-Pyridin-2-yl-phenyl)-1-aza-bicyclo[2.2.2]octan-3-ol
CID 9838609
Pyrinoline
CID 3052765
4-Phenyl-1-(phenyl(pyridin-2-yl)methyl)piperidin-4-ol
CID 44426822
2,3-Di(2-pyridyl)-2,3-butanediol
CID 579625
Osmium(2+), bis(2,2'-bipyridine-N,N')(mu-(1,4-bis((2,2':6',2''-terpyridin)-6-ylmethyl)-1,4-cyclohexanediol-N(sup 1),N(sup 1'),N(sup 1''):N(sup 4),N(sup 4'),N(sup 4''))-dichlorodi-, dichloride
CID 3044407
Dihydroxyosmarine tetrachloride
CID 11980054
1-Phenyl-4-(1-piperidinyl)-1-(2-pyridinyl)-1-butanol hydrochloride
CID 14810560
3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1,1-dipyridin-2-ylprop-2-yn-1-ol
CID 44406464
Phenyl-[7-[phenyl(pyridin-2-yl)methylidene]-2-bicyclo[2.2.1]hept-2-enyl]-pyridin-2-ylmethanol
CID 44424920

Frequently Asked Questions

What is the IUPAC name of pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol?
The IUPAC name of pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol (CID 102494319) is pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol.
What is the SMILES notation for pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol?
The canonical SMILES for pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol is OC(c1ccccn1)(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1.
What is the InChIKey of pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol?
The InChIKey is LKNRZRUGYIJCLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N5O/c32-26(23-13-3-6-18-29-23,24-14-7-11-21(30-24)19-9-1-4-16-27-19)25-15-8-12-22(31-25)20-10-2-5-17-28-20/h1-18,32H.
What are the key properties of pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol?
pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol has a molecular weight of 417.47 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol is sourced from PubChem (CID 102494319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).