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

C21H14N4O — CID 91378140

IUPACbis(6-pyridin-2-yl-2-pyridinyl)methanone
SMILESO=C(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C21H14N4O/c26-21(19-11-5-9-17(24-19)15-7-1-3-13-22-15)20-12-6-10-18(25-20)16-8-2-4-14-23-16/h1-14H
InChIKeyHNPBJKGEBCUTCO-UHFFFAOYSA-N
MW338.37 g/mol
LogP3.83
Rot. Bonds4

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

bis(6-pyridin-2-yl-2-pyridinyl)methanone (PubChem CID 91378140) has the molecular formula C21H14N4O and a molecular weight of 338.37 g/mol. Its IUPAC name is bis(6-pyridin-2-yl-2-pyridinyl)methanone.

Molecular Properties

Compound Namebis(6-pyridin-2-yl-2-pyridinyl)methanone
PubChem CID91378140
Molecular FormulaC21H14N4O
Molecular Weight338.37 g/mol
Exact Mass338.12
IUPAC Namebis(6-pyridin-2-yl-2-pyridinyl)methanone
SMILESO=C(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C21H14N4O/c26-21(19-11-5-9-17(24-19)15-7-1-3-13-22-15)20-12-6-10-18(25-20)16-8-2-4-14-23-16/h1-14H
InChIKeyHNPBJKGEBCUTCO-UHFFFAOYSA-N
XLogP3.83
TPSA68.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Di-2-pyridylethanedione
CID 68115
Bis(2-pyridyl) ketone
CID 88065
3-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-6-pyridin-2-ylpyridine-2-carboxamide
CID 69090096
Piperazine-1,4-diylbis(pyridin-2-ylmethanone)
CID 258989
1-[2-Oxo-2-(2-pyridyl)ethyl]pyridinium Iodide
CID 213499
1,3-Di(2-pyridyl)-1,3-propanedione
CID 2728494
N'~2~,N'~6~-bis(2-pyridinylmethylene)-2,6-pyridinedicarbohydrazide
CID 5437141
(E)-1,3-bis(2-pyridyl)prop-2-en-1-one
CID 6474703
1,5-Bis(2-pyridyl)-1,3,5-pentanetrione
CID 11369181
[3-(4-Phenylpiperazin-1-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 24819464
Bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone
CID 118706530
[6-[6-(Triazolo[1,5-a]pyridin-3-yl)pyridine-2-carbonyl]-2-pyridinyl]-[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone
CID 118707123

Frequently Asked Questions

What is the IUPAC name of bis(6-pyridin-2-yl-2-pyridinyl)methanone?
The IUPAC name of bis(6-pyridin-2-yl-2-pyridinyl)methanone (CID 91378140) is bis(6-pyridin-2-yl-2-pyridinyl)methanone.
What is the SMILES notation for bis(6-pyridin-2-yl-2-pyridinyl)methanone?
The canonical SMILES for bis(6-pyridin-2-yl-2-pyridinyl)methanone is O=C(c1cccc(-c2ccccn2)n1)c1cccc(-c2ccccn2)n1.
What is the InChIKey of bis(6-pyridin-2-yl-2-pyridinyl)methanone?
The InChIKey is HNPBJKGEBCUTCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N4O/c26-21(19-11-5-9-17(24-19)15-7-1-3-13-22-15)20-12-6-10-18(25-20)16-8-2-4-14-23-16/h1-14H.
What are the key properties of bis(6-pyridin-2-yl-2-pyridinyl)methanone?
bis(6-pyridin-2-yl-2-pyridinyl)methanone has a molecular weight of 338.37 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-pyridin-2-yl-2-pyridinyl)methanone is sourced from PubChem (CID 91378140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).