7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde

C10H7F3N2O — CID 115405083

IUPAC7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccn2c(C=O)c(C(F)(F)F)nc2c1
InChIInChI=1S/C10H7F3N2O/c1-6-2-3-15-7(5-16)9(10(11,12)13)14-8(15)4-6/h2-5H,1H3
InChIKeyWBKGUXWMVBGZFR-UHFFFAOYSA-N
MW228.17 g/mol
LogP2.47
Rot. Bonds1

About 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde

7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 115405083) has the molecular formula C10H7F3N2O and a molecular weight of 228.17 g/mol. Its IUPAC name is 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID115405083
Molecular FormulaC10H7F3N2O
Molecular Weight228.17 g/mol
Exact Mass228.05
IUPAC Name7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccn2c(C=O)c(C(F)(F)F)nc2c1
InChIInChI=1S/C10H7F3N2O/c1-6-2-3-15-7(5-16)9(10(11,12)13)14-8(15)4-6/h2-5H,1H3
InChIKeyWBKGUXWMVBGZFR-UHFFFAOYSA-N
XLogP2.47
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.17
LogP ≤ 52.47
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

2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 44820379
7-methyl-2-(1-methylcyclopropyl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 165499776
(E)-3-(dimethylamino)-1-[7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]prop-2-en-1-one
CID 59176932
[7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methyl methanesulfonate
CID 23247006
2-tert-butyl-3-iodo-7-methylimidazo[1,2-a]pyridine
CID 10543240
3-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 141394707
4,8-dimethylpyrido[1,2-a]pyrimidin-2-one
CID 599966
(2-tert-butyl-7-methylimidazo[1,2-a]pyridin-3-yl)methanol
CID 82029708
1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine
CID 82029238
1-(2-tert-butyl-7-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dimethylmethanamine
CID 39146035
2,7-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274552
2,7-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530134

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde (CID 115405083) is 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde is Cc1ccn2c(C=O)c(C(F)(F)F)nc2c1.
What is the InChIKey of 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is WBKGUXWMVBGZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2O/c1-6-2-3-15-7(5-16)9(10(11,12)13)14-8(15)4-6/h2-5H,1H3.
What are the key properties of 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde?
7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 228.17 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 115405083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).