3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde

C19H15NO — CID 101484280

IUPAC3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde
SMILESCc1cccnc1-c1ccccc1-c1cccc(C=O)c1
InChIInChI=1S/C19H15NO/c1-14-6-5-11-20-19(14)18-10-3-2-9-17(18)16-8-4-7-15(12-16)13-21/h2-13H,1H3
InChIKeyUWZCIAIECZVKSV-UHFFFAOYSA-N
MW273.33 g/mol
LogP4.54
Rot. Bonds3

About 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde

3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde (PubChem CID 101484280) has the molecular formula C19H15NO and a molecular weight of 273.33 g/mol. Its IUPAC name is 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde.

Molecular Properties

Compound Name3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde
PubChem CID101484280
Molecular FormulaC19H15NO
Molecular Weight273.33 g/mol
Exact Mass273.12
IUPAC Name3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde
SMILESCc1cccnc1-c1ccccc1-c1cccc(C=O)c1
InChIInChI=1S/C19H15NO/c1-14-6-5-11-20-19(14)18-10-3-2-9-17(18)16-8-4-7-15(12-16)13-21/h2-13H,1H3
InChIKeyUWZCIAIECZVKSV-UHFFFAOYSA-N
XLogP4.54
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 54.54
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

3-(2-fluoro-3-pyridinyl)benzaldehyde
CID 165111787
3-pyrimidin-2-ylbenzaldehyde
CID 22630818
2-fluoro-6-(3-methyl-2-pyridinyl)benzaldehyde
CID 172968774
2-(3-formylphenyl)benzaldehyde
CID 57186210
3-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]benzaldehyde
CID 166557395
3-(2,3,4,5-tetramethylphenyl)benzaldehyde
CID 87595803
3-methyl-2-(3-phenylphenyl)pyridine
CID 58975820
3-[2-(dimethylamino)phenyl]benzaldehyde
CID 82107320
3-(3-methoxypyrazin-2-yl)benzaldehyde
CID 104516184
3-(5-methylpyrimidin-4-yl)benzaldehyde
CID 166845050
2-(3-methyl-2-pyridinyl)benzenethiol
CID 137155222
3-(3-methyl-2-pyridinyl)-N-[3-(3-methyl-2-pyridinyl)phenyl]aniline
CID 90070817

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde?
The IUPAC name of 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde (CID 101484280) is 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde.
What is the SMILES notation for 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde?
The canonical SMILES for 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde is Cc1cccnc1-c1ccccc1-c1cccc(C=O)c1.
What is the InChIKey of 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde?
The InChIKey is UWZCIAIECZVKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-14-6-5-11-20-19(14)18-10-3-2-9-17(18)16-8-4-7-15(12-16)13-21/h2-13H,1H3.
What are the key properties of 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde?
3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde has a molecular weight of 273.33 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-methyl-2-pyridinyl)phenyl]benzaldehyde is sourced from PubChem (CID 101484280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).