1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine

C11H12F3N3 — CID 82029238

IUPAC1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine
SMILESCc1ccn2c(C(N)C(F)(F)F)c(C)nc2c1
InChIInChI=1S/C11H12F3N3/c1-6-3-4-17-8(5-6)16-7(2)9(17)10(15)11(12,13)14/h3-5,10H,15H2,1-2H3
InChIKeyOZFGCNMEKUYAHW-UHFFFAOYSA-N
MW243.23 g/mol
LogP2.51
Rot. Bonds1

About 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine

1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine (PubChem CID 82029238) has the molecular formula C11H12F3N3 and a molecular weight of 243.23 g/mol. Its IUPAC name is 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine.

Molecular Properties

Compound Name1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine
PubChem CID82029238
Molecular FormulaC11H12F3N3
Molecular Weight243.23 g/mol
Exact Mass243.10
IUPAC Name1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine
SMILESCc1ccn2c(C(N)C(F)(F)F)c(C)nc2c1
InChIInChI=1S/C11H12F3N3/c1-6-3-4-17-8(5-6)16-7(2)9(17)10(15)11(12,13)14/h3-5,10H,15H2,1-2H3
InChIKeyOZFGCNMEKUYAHW-UHFFFAOYSA-N
XLogP2.51
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.23
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine?
The IUPAC name of 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine (CID 82029238) is 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine.
What is the SMILES notation for 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine?
The canonical SMILES for 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine is Cc1ccn2c(C(N)C(F)(F)F)c(C)nc2c1.
What is the InChIKey of 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine?
The InChIKey is OZFGCNMEKUYAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N3/c1-6-3-4-17-8(5-6)16-7(2)9(17)10(15)11(12,13)14/h3-5,10H,15H2,1-2H3.
What are the key properties of 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine?
1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine has a molecular weight of 243.23 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-2,2,2-trifluoroethanamine is sourced from PubChem (CID 82029238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).