4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde

C14H11N3OS — CID 171095802

IUPAC4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde
SMILESO=Cc1snc(-c2cccc3nccn23)c1C1CC1
InChIInChI=1S/C14H11N3OS/c18-8-11-13(9-4-5-9)14(16-19-11)10-2-1-3-12-15-6-7-17(10)12/h1-3,6-9H,4-5H2
InChIKeyZEFJSIKZOVSWFS-UHFFFAOYSA-N
MW269.33 g/mol
LogP3.15
Rot. Bonds3

About 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde

4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde (PubChem CID 171095802) has the molecular formula C14H11N3OS and a molecular weight of 269.33 g/mol. Its IUPAC name is 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde.

Molecular Properties

Compound Name4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde
PubChem CID171095802
Molecular FormulaC14H11N3OS
Molecular Weight269.33 g/mol
Exact Mass269.06
IUPAC Name4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde
SMILESO=Cc1snc(-c2cccc3nccn23)c1C1CC1
InChIInChI=1S/C14H11N3OS/c18-8-11-13(9-4-5-9)14(16-19-11)10-2-1-3-12-15-6-7-17(10)12/h1-3,6-9H,4-5H2
InChIKeyZEFJSIKZOVSWFS-UHFFFAOYSA-N
XLogP3.15
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-4-imidazo[1,2-a]pyridin-5-yl-1,2,5-thiadiazole
CID 102627264
N-[3-chloro-4-(3-hydroxyazetidine-1-carbonyl)phenyl]-4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carboxamide;ethane;sulfane
CID 171096222
3-imidazo[1,2-a]pyridin-5-yl-9λ6-thiabicyclo[3.3.1]non-2-ene 9,9-dioxide
CID 171974714
5-(5-chloropyrimidin-4-yl)imidazo[1,2-a]pyridine
CID 102627237
ethane;5-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 142047032
5-imidazo[1,2-a]pyridin-5-ylpyrimidin-2-amine
CID 102626318
2-imidazo[1,2-a]pyridin-5-ylaniline
CID 102626302
6-imidazo[1,2-a]pyridin-5-yl-5-nitropyrimidin-4-amine
CID 102627390
(5-imidazo[1,2-a]pyridin-5-ylthiophen-2-yl)methanamine
CID 102626306
N-cyclooctylimidazo[1,2-a]pyridin-5-amine
CID 102625331
3-imidazo[1,2-a]pyridin-5-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
CID 103342054
5-fluoro-4-imidazo[1,2-a]pyridin-5-yl-N-methylpyrimidin-2-amine
CID 102627276

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde?
The IUPAC name of 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde (CID 171095802) is 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde.
What is the SMILES notation for 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde?
The canonical SMILES for 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde is O=Cc1snc(-c2cccc3nccn23)c1C1CC1.
What is the InChIKey of 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde?
The InChIKey is ZEFJSIKZOVSWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3OS/c18-8-11-13(9-4-5-9)14(16-19-11)10-2-1-3-12-15-6-7-17(10)12/h1-3,6-9H,4-5H2.
What are the key properties of 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde?
4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde has a molecular weight of 269.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-3-imidazo[1,2-a]pyridin-5-yl-1,2-thiazole-5-carbaldehyde is sourced from PubChem (CID 171095802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).