ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine

C12H15F4N3 — CID 171509083

IUPACethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine
SMILESCC.Cc1c(C(N)C(F)(F)F)nc2ccc(F)cn12
InChIInChI=1S/C10H9F4N3.C2H6/c1-5-8(9(15)10(12,13)14)16-7-3-2-6(11)4-17(5)7;1-2/h2-4,9H,15H2,1H3;1-2H3
InChIKeyYZXLGFDLCNUVFV-UHFFFAOYSA-N
MW277.27 g/mol
LogP3.37
Rot. Bonds1

About ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine

ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine (PubChem CID 171509083) has the molecular formula C12H15F4N3 and a molecular weight of 277.27 g/mol. Its IUPAC name is ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine.

Molecular Properties

Compound Nameethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine
PubChem CID171509083
Molecular FormulaC12H15F4N3
Molecular Weight277.27 g/mol
Exact Mass277.12
IUPAC Nameethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine
SMILESCC.Cc1c(C(N)C(F)(F)F)nc2ccc(F)cn12
InChIInChI=1S/C10H9F4N3.C2H6/c1-5-8(9(15)10(12,13)14)16-7-3-2-6(11)4-17(5)7;1-2/h2-4,9H,15H2,1H3;1-2H3
InChIKeyYZXLGFDLCNUVFV-UHFFFAOYSA-N
XLogP3.37
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine?
The IUPAC name of ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine (CID 171509083) is ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine.
What is the SMILES notation for ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine?
The canonical SMILES for ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine is CC.Cc1c(C(N)C(F)(F)F)nc2ccc(F)cn12.
What is the InChIKey of ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine?
The InChIKey is YZXLGFDLCNUVFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F4N3.C2H6/c1-5-8(9(15)10(12,13)14)16-7-3-2-6(11)4-17(5)7;1-2/h2-4,9H,15H2,1H3;1-2H3.
What are the key properties of ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine?
ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine has a molecular weight of 277.27 g/mol, XLogP of 3.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,2,2-trifluoro-1-(6-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)ethanamine is sourced from PubChem (CID 171509083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).