5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde

C11H13NO2 — CID 79794927

IUPAC5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde
SMILESO=Cc1ccc(OCCC2CC2)cn1
InChIInChI=1S/C11H13NO2/c13-8-10-3-4-11(7-12-10)14-6-5-9-1-2-9/h3-4,7-9H,1-2,5-6H2
InChIKeyGBAIPJACJWYOCO-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.07
Rot. Bonds5

About 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde

5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde (PubChem CID 79794927) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde.

Molecular Properties

Compound Name5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde
PubChem CID79794927
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde
SMILESO=Cc1ccc(OCCC2CC2)cn1
InChIInChI=1S/C11H13NO2/c13-8-10-3-4-11(7-12-10)14-6-5-9-1-2-9/h3-4,7-9H,1-2,5-6H2
InChIKeyGBAIPJACJWYOCO-UHFFFAOYSA-N
XLogP2.07
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(2-cyclopropylethoxy)pyridine-2-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

5-(cyclopropylmethoxy)pyridine-2-carbaldehyde
CID 79793773
5-pent-4-enoxypyridine-2-carbaldehyde
CID 79794228
5-(3-methoxy-3-methylbutoxy)pyridine-2-carbaldehyde
CID 103033835
1-[5-(2-cyclobutylethoxy)-2-pyridinyl]ethanone
CID 106202175
5-(3-phenylpropoxy)pyridine-2-carbaldehyde
CID 79794594
5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136731200
5-[2-(4-methylpiperazin-1-yl)ethoxy]pyridine-2-carbaldehyde
CID 82892009
N-cyclopentyl-2-[(6-formyl-3-pyridinyl)oxy]acetamide
CID 79793955
5-(2-pyridin-2-ylethoxy)pyridine-2-carbaldehyde
CID 79793881
4-(2-cyclopropylethoxy)pyridine
CID 174949801
butyl 2-[(6-formyl-3-pyridinyl)oxy]acetate
CID 79794234
5-but-2-ynoxypyridine-2-carbaldehyde
CID 79794219

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde?
The IUPAC name of 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde (CID 79794927) is 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde.
What is the SMILES notation for 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde?
The canonical SMILES for 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde is O=Cc1ccc(OCCC2CC2)cn1.
What is the InChIKey of 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde?
The InChIKey is GBAIPJACJWYOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c13-8-10-3-4-11(7-12-10)14-6-5-9-1-2-9/h3-4,7-9H,1-2,5-6H2.
What are the key properties of 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde?
5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde has a molecular weight of 191.23 g/mol, XLogP of 2.07, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopropylethoxy)pyridine-2-carbaldehyde is sourced from PubChem (CID 79794927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).