2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde

C14H17N3O — CID 83965836

IUPAC2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
SMILESCc1cc2nc(C3CCCCC3)nn2cc1C=O
InChIInChI=1S/C14H17N3O/c1-10-7-13-15-14(11-5-3-2-4-6-11)16-17(13)8-12(10)9-18/h7-9,11H,2-6H2,1H3
InChIKeyDXGVYTVRBRPLHD-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.90
Rot. Bonds2

About 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde

2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde (PubChem CID 83965836) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
PubChem CID83965836
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
SMILESCc1cc2nc(C3CCCCC3)nn2cc1C=O
InChIInChI=1S/C14H17N3O/c1-10-7-13-15-14(11-5-3-2-4-6-11)16-17(13)8-12(10)9-18/h7-9,11H,2-6H2,1H3
InChIKeyDXGVYTVRBRPLHD-UHFFFAOYSA-N
XLogP2.90
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 83965837
2-(3,4-difluorophenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 83965863
2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 75481318
3-cyclohexyl-1-(3,5-dimethylphenyl)pyrazole-4-carbaldehyde
CID 43805609
3-cyclopentyl-1-(3,5-dimethylphenyl)pyrazole-4-carbaldehyde
CID 62631545
2-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
CID 82567152
1-(4-bromo-2-methylphenyl)-3-cyclohexylpyrazole-4-carbaldehyde
CID 104508751
2-(1-propan-2-ylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 117128935
3-cyclohexyl-1-(4-fluoro-2-methylphenyl)pyrazole-4-carbaldehyde
CID 63859264
3-cyclohexyl-2-methylbenzaldehyde
CID 15107628
3-cyclopentyl-1-(2,5-dimethylphenyl)pyrazole-4-carbaldehyde
CID 62633883
4-cyclohexyl-5-methylbenzene-1,3-dicarbaldehyde
CID 168738456

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde?
The IUPAC name of 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde (CID 83965836) is 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde?
The canonical SMILES for 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde is Cc1cc2nc(C3CCCCC3)nn2cc1C=O.
What is the InChIKey of 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde?
The InChIKey is DXGVYTVRBRPLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-10-7-13-15-14(11-5-3-2-4-6-11)16-17(13)8-12(10)9-18/h7-9,11H,2-6H2,1H3.
What are the key properties of 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde?
2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde has a molecular weight of 243.31 g/mol, XLogP of 2.90, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-7-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 83965836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).