3-(2-phenylphenyl)pyridine-2-carbaldehyde

C18H13NO — CID 87513026

IUPAC3-(2-phenylphenyl)pyridine-2-carbaldehyde
SMILESO=Cc1ncccc1-c1ccccc1-c1ccccc1
InChIInChI=1S/C18H13NO/c20-13-18-17(11-6-12-19-18)16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-13H
InChIKeyNYLBBPSFBNTQJK-UHFFFAOYSA-N
MW259.31 g/mol
LogP4.23
Rot. Bonds3

About 3-(2-phenylphenyl)pyridine-2-carbaldehyde

3-(2-phenylphenyl)pyridine-2-carbaldehyde (PubChem CID 87513026) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-(2-phenylphenyl)pyridine-2-carbaldehyde.

Molecular Properties

Compound Name3-(2-phenylphenyl)pyridine-2-carbaldehyde
PubChem CID87513026
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name3-(2-phenylphenyl)pyridine-2-carbaldehyde
SMILESO=Cc1ncccc1-c1ccccc1-c1ccccc1
InChIInChI=1S/C18H13NO/c20-13-18-17(11-6-12-19-18)16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-13H
InChIKeyNYLBBPSFBNTQJK-UHFFFAOYSA-N
XLogP4.23
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-Benzoylpyridine
CID 7038
4-Quinolinecarboxaldehyde
CID 78072
(e)-2-(Pyridin-2-ylmethylene)-2,3-dihydro-1h-inden-1-one
CID 6526506
2-Isoquinolinium-2-yl-1-phenylethan-1-one bromide
CID 2794851
1-Isoquinolinyl phenyl ketone
CID 280081
2-Phenyl-1-(pyridin-2-yl)ethan-1-one
CID 256073
2-Acetyl-4-isopropylpyridine
CID 529345
N-(pyridin-3-yl)biphenyl-2-carboxamide
CID 679747
N-[[phenyl(pyridin-2-yl)methylidene]amino]benzamide
CID 2351493
1,5-Diphenyl-3-(pyridin-4-yl)pentane-1,5-dione
CID 219448
1-Phenyl-3-(pyridin-2-yl)propane-1,3-dione
CID 238448
1-Phenyl-2-(2-pyridinyl)ethanone
CID 74179

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenylphenyl)pyridine-2-carbaldehyde?
The IUPAC name of 3-(2-phenylphenyl)pyridine-2-carbaldehyde (CID 87513026) is 3-(2-phenylphenyl)pyridine-2-carbaldehyde.
What is the SMILES notation for 3-(2-phenylphenyl)pyridine-2-carbaldehyde?
The canonical SMILES for 3-(2-phenylphenyl)pyridine-2-carbaldehyde is O=Cc1ncccc1-c1ccccc1-c1ccccc1.
What is the InChIKey of 3-(2-phenylphenyl)pyridine-2-carbaldehyde?
The InChIKey is NYLBBPSFBNTQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c20-13-18-17(11-6-12-19-18)16-10-5-4-9-15(16)14-7-2-1-3-8-14/h1-13H.
What are the key properties of 3-(2-phenylphenyl)pyridine-2-carbaldehyde?
3-(2-phenylphenyl)pyridine-2-carbaldehyde has a molecular weight of 259.31 g/mol, XLogP of 4.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenylphenyl)pyridine-2-carbaldehyde is sourced from PubChem (CID 87513026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).