6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde

C12H13BrN2O — CID 83170979

IUPAC6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCCCc1nc2c(C)cc(Br)cn2c1C=O
InChIInChI=1S/C12H13BrN2O/c1-3-4-10-11(7-16)15-6-9(13)5-8(2)12(15)14-10/h5-7H,3-4H2,1-2H3
InChIKeyWNAZONASZHRGQI-UHFFFAOYSA-N
MW281.15 g/mol
LogP3.17
Rot. Bonds3

About 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde

6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 83170979) has the molecular formula C12H13BrN2O and a molecular weight of 281.15 g/mol. Its IUPAC name is 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID83170979
Molecular FormulaC12H13BrN2O
Molecular Weight281.15 g/mol
Exact Mass280.02
IUPAC Name6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCCCc1nc2c(C)cc(Br)cn2c1C=O
InChIInChI=1S/C12H13BrN2O/c1-3-4-10-11(7-16)15-6-9(13)5-8(2)12(15)14-10/h5-7H,3-4H2,1-2H3
InChIKeyWNAZONASZHRGQI-UHFFFAOYSA-N
XLogP3.17
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.15
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 115405133
6-bromo-3-[(2-methoxyphenyl)methyl]-8-methyl-2-propylimidazo[1,2-a]pyridine
CID 51359980
7-bromo-2-hydroxy-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 162341321
2-benzyl-6-bromo-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83170655
2-[(6-bromo-8-methyl-3-propylimidazo[1,2-a]pyridin-2-yl)amino]-N-hydroxypropanamide
CID 141240860
6-bromo-2-butan-2-yl-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83171128
6-bromo-3-ethyl-8-methylimidazo[1,2-a]pyridine
CID 83170189
6-bromo-2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 83170033
6-bromo-8-methyl-3-nitrosoimidazo[1,2-a]pyridine-2-carboxylic acid
CID 82356898
1-(6-bromo-2,8-dimethylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82531143
2,3-dimethyl-6-propylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 83085706
8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530955

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde (CID 83170979) is 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde is CCCc1nc2c(C)cc(Br)cn2c1C=O.
What is the InChIKey of 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is WNAZONASZHRGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN2O/c1-3-4-10-11(7-16)15-6-9(13)5-8(2)12(15)14-10/h5-7H,3-4H2,1-2H3.
What are the key properties of 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde?
6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 281.15 g/mol, XLogP of 3.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-methyl-2-propylimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 83170979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).