3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine

C14H19F3N4 — CID 63785003

IUPAC3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCCN(CC(F)(F)F)c1nc2ccccn2c1CCN
InChIInChI=1S/C14H19F3N4/c1-2-8-20(10-14(15,16)17)13-11(6-7-18)21-9-4-3-5-12(21)19-13/h3-5,9H,2,6-8,10,18H2,1H3
InChIKeyAOPNURKGJXUABB-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.61
Rot. Bonds6

About 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine

3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine (PubChem CID 63785003) has the molecular formula C14H19F3N4 and a molecular weight of 300.33 g/mol. Its IUPAC name is 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine
PubChem CID63785003
Molecular FormulaC14H19F3N4
Molecular Weight300.33 g/mol
Exact Mass300.16
IUPAC Name3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCCN(CC(F)(F)F)c1nc2ccccn2c1CCN
InChIInChI=1S/C14H19F3N4/c1-2-8-20(10-14(15,16)17)13-11(6-7-18)21-9-4-3-5-12(21)19-13/h3-5,9H,2,6-8,10,18H2,1H3
InChIKeyAOPNURKGJXUABB-UHFFFAOYSA-N
XLogP2.61
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine (CID 63785003) is 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine is CCCN(CC(F)(F)F)c1nc2ccccn2c1CCN.
What is the InChIKey of 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine?
The InChIKey is AOPNURKGJXUABB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N4/c1-2-8-20(10-14(15,16)17)13-11(6-7-18)21-9-4-3-5-12(21)19-13/h3-5,9H,2,6-8,10,18H2,1H3.
What are the key properties of 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine?
3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine has a molecular weight of 300.33 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 63785003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).