6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde

C14H14N2O2 — CID 79267439

IUPAC6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde
SMILESCc1cccc(COc2ccc(C)nc2C=O)n1
InChIInChI=1S/C14H14N2O2/c1-10-4-3-5-12(15-10)9-18-14-7-6-11(2)16-13(14)8-17/h3-8H,9H2,1-2H3
InChIKeyOPLSPPGCUHVSLB-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.48
Rot. Bonds4

About 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde

6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde (PubChem CID 79267439) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde
PubChem CID79267439
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde
SMILESCc1cccc(COc2ccc(C)nc2C=O)n1
InChIInChI=1S/C14H14N2O2/c1-10-4-3-5-12(15-10)9-18-14-7-6-11(2)16-13(14)8-17/h3-8H,9H2,1-2H3
InChIKeyOPLSPPGCUHVSLB-UHFFFAOYSA-N
XLogP2.48
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-3-[(2-methyl-1,3-thiazol-4-yl)methoxy]pyridine-2-carbaldehyde
CID 79035489
3-chloro-4-[(6-methyl-2-pyridinyl)methoxy]benzaldehyde
CID 79267100
3-[(2-methoxyphenyl)methoxy]-6-methylpyridine-2-carbaldehyde
CID 78929164
6-methyl-3-(quinolin-8-ylmethoxy)pyridine-2-carbaldehyde
CID 78929085
3-[(3-methoxyphenyl)methoxy]-6-methylpyridine-2-carbaldehyde
CID 78929137
2-(bromomethyl)-6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine
CID 79260859
3-[(3,5-difluorophenyl)methoxy]-6-methylpyridine-2-carbaldehyde
CID 105403665
6-methyl-3-[[3-(trifluoromethyl)phenyl]methoxy]pyridine-2-carbaldehyde
CID 78929099
6-methyl-3-[(3-nitrophenyl)methoxy]pyridine-2-carbaldehyde
CID 78929256
3-[(2,5-dimethylpyrazol-3-yl)methoxy]-6-methylpyridine-2-carbaldehyde
CID 79158515
3-hept-6-enoxy-6-methylpyridine-2-carbaldehyde
CID 107007333
5-[(2-formyl-6-methyl-3-pyridinyl)oxy]pentanenitrile
CID 79158850

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde?
The IUPAC name of 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde (CID 79267439) is 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde.
What is the SMILES notation for 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde?
The canonical SMILES for 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde is Cc1cccc(COc2ccc(C)nc2C=O)n1.
What is the InChIKey of 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde?
The InChIKey is OPLSPPGCUHVSLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-4-3-5-12(15-10)9-18-14-7-6-11(2)16-13(14)8-17/h3-8H,9H2,1-2H3.
What are the key properties of 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde?
6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde has a molecular weight of 242.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]pyridine-2-carbaldehyde is sourced from PubChem (CID 79267439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).