2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde

C12H9N3OS — CID 82386327

IUPAC2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCc1cnc(-c2cn3cc(C=O)ccc3n2)s1
InChIInChI=1S/C12H9N3OS/c1-8-4-13-12(17-8)10-6-15-5-9(7-16)2-3-11(15)14-10/h2-7H,1H3
InChIKeyIWNNQZBNSLXUAV-UHFFFAOYSA-N
MW243.29 g/mol
LogP2.58
Rot. Bonds2

About 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde

2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde (PubChem CID 82386327) has the molecular formula C12H9N3OS and a molecular weight of 243.29 g/mol. Its IUPAC name is 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
PubChem CID82386327
Molecular FormulaC12H9N3OS
Molecular Weight243.29 g/mol
Exact Mass243.05
IUPAC Name2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCc1cnc(-c2cn3cc(C=O)ccc3n2)s1
InChIInChI=1S/C12H9N3OS/c1-8-4-13-12(17-8)10-6-15-5-9(7-16)2-3-11(15)14-10/h2-7H,1H3
InChIKeyIWNNQZBNSLXUAV-UHFFFAOYSA-N
XLogP2.58
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 52.58
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

2-(2-bromophenyl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 84739483
2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 10754921
4-[(5-methyl-1,3-thiazol-2-yl)methyl]benzaldehyde
CID 164574135
6-formylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 23155605
2-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117128929
2-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117130572
ethane;5-methyl-2-(4-methylphenyl)-1,3-thiazole
CID 123316346
(Z)-3-[4-[6-[(Z)-3-oxoprop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enal
CID 99726261
tert-butyl N-[(6-formylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
CID 155167684
2-(2-methylpyrimidin-4-yl)-1,3-thiazole-5-carbaldehyde
CID 115528106
4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde
CID 820963
[1,2,4]triazolo[4,3-a]pyridine-6-carbaldehyde
CID 82417711

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde?
The IUPAC name of 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde (CID 82386327) is 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde?
The canonical SMILES for 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde is Cc1cnc(-c2cn3cc(C=O)ccc3n2)s1.
What is the InChIKey of 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde?
The InChIKey is IWNNQZBNSLXUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3OS/c1-8-4-13-12(17-8)10-6-15-5-9(7-16)2-3-11(15)14-10/h2-7H,1H3.
What are the key properties of 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde?
2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde has a molecular weight of 243.29 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 82386327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).