bis(2-pyridin-3-ylphenyl)methanone

C23H16N2O — CID 70483268

IUPACbis(2-pyridin-3-ylphenyl)methanone
SMILESO=C(c1ccccc1-c1cccnc1)c1ccccc1-c1cccnc1
InChIInChI=1S/C23H16N2O/c26-23(21-11-3-1-9-19(21)17-7-5-13-24-15-17)22-12-4-2-10-20(22)18-8-6-14-25-16-18/h1-16H
InChIKeySXCNSIMVOBTSFV-UHFFFAOYSA-N
MW336.39 g/mol
LogP5.04
Rot. Bonds4

About bis(2-pyridin-3-ylphenyl)methanone

bis(2-pyridin-3-ylphenyl)methanone (PubChem CID 70483268) has the molecular formula C23H16N2O and a molecular weight of 336.39 g/mol. Its IUPAC name is bis(2-pyridin-3-ylphenyl)methanone.

Molecular Properties

Compound Namebis(2-pyridin-3-ylphenyl)methanone
PubChem CID70483268
Molecular FormulaC23H16N2O
Molecular Weight336.39 g/mol
Exact Mass336.13
IUPAC Namebis(2-pyridin-3-ylphenyl)methanone
SMILESO=C(c1ccccc1-c1cccnc1)c1ccccc1-c1cccnc1
InChIInChI=1S/C23H16N2O/c26-23(21-11-3-1-9-19(21)17-7-5-13-24-15-17)22-12-4-2-10-20(22)18-8-6-14-25-16-18/h1-16H
InChIKeySXCNSIMVOBTSFV-UHFFFAOYSA-N
XLogP5.04
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-yl-3-pyridin-3-ylbenzoic acid
CID 68921390
2-pyridin-3-yl-N-pyrrolidin-1-ylbenzamide
CID 173109803
2-chloro-3-pyridin-3-ylbenzoic acid
CID 46317024
N-piperidin-1-yl-2-pyridin-3-ylbenzamide
CID 173109627
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
2-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzamide
CID 139933693
3-(2-methylphenyl)pyridine
CID 4133191
(2-pyridin-3-ylphenyl)carbamic acid
CID 174385651
phenyl-[2-(2-phenylbenzoyl)phenyl]methanone
CID 141429590
3-phenyl-6-pyridin-3-ylpyridazine
CID 12712239
(2S)-2-amino-2-(2-pyridin-3-ylphenyl)acetic acid
CID 66512915
3-(2-methyl-3-phenylphenyl)pyridine
CID 91046767

Frequently Asked Questions

What is the IUPAC name of bis(2-pyridin-3-ylphenyl)methanone?
The IUPAC name of bis(2-pyridin-3-ylphenyl)methanone (CID 70483268) is bis(2-pyridin-3-ylphenyl)methanone.
What is the SMILES notation for bis(2-pyridin-3-ylphenyl)methanone?
The canonical SMILES for bis(2-pyridin-3-ylphenyl)methanone is O=C(c1ccccc1-c1cccnc1)c1ccccc1-c1cccnc1.
What is the InChIKey of bis(2-pyridin-3-ylphenyl)methanone?
The InChIKey is SXCNSIMVOBTSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O/c26-23(21-11-3-1-9-19(21)17-7-5-13-24-15-17)22-12-4-2-10-20(22)18-8-6-14-25-16-18/h1-16H.
What are the key properties of bis(2-pyridin-3-ylphenyl)methanone?
bis(2-pyridin-3-ylphenyl)methanone has a molecular weight of 336.39 g/mol, XLogP of 5.04, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-pyridin-3-ylphenyl)methanone is sourced from PubChem (CID 70483268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).