2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine

C16H13ClF3N3 — CID 90159283

IUPAC2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESNCCc1c(-c2cccc(Cl)c2)nc2ccc(C(F)(F)F)cn12
InChIInChI=1S/C16H13ClF3N3/c17-12-3-1-2-10(8-12)15-13(6-7-21)23-9-11(16(18,19)20)4-5-14(23)22-15/h1-5,8-9H,6-7,21H2
InChIKeyZQZNRYSNZOWBJR-UHFFFAOYSA-N
MW339.75 g/mol
LogP4.17
Rot. Bonds3

About 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine

2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine (PubChem CID 90159283) has the molecular formula C16H13ClF3N3 and a molecular weight of 339.75 g/mol. Its IUPAC name is 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
PubChem CID90159283
Molecular FormulaC16H13ClF3N3
Molecular Weight339.75 g/mol
Exact Mass339.08
IUPAC Name2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESNCCc1c(-c2cccc(Cl)c2)nc2ccc(C(F)(F)F)cn12
InChIInChI=1S/C16H13ClF3N3/c17-12-3-1-2-10(8-12)15-13(6-7-21)23-9-11(16(18,19)20)4-5-14(23)22-15/h1-5,8-9H,6-7,21H2
InChIKeyZQZNRYSNZOWBJR-UHFFFAOYSA-N
XLogP4.17
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.75
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-chloro-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 28866284
6-bromo-2-(3-chlorophenyl)-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine
CID 51361246
[2-(3-methoxyphenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 46224159
2-[2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060793
2-[6-fluoro-2-(4-fluoro-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82530532
3-[2-(4-chlorophenyl)-6-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 83286723
2-(3-chlorophenyl)-3-[(3-chlorophenyl)methyl]-6-methylimidazo[1,2-a]pyridine
CID 51359989
3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-cyclopropylpropanamide
CID 83289107
3-[6-bromo-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 170878846
3-[2-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-[(1R)-1-phenylethyl]propanamide
CID 98295538
6-bromo-2-(3-chlorophenyl)-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 51360616
6-bromo-2-(4-chlorophenyl)-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
CID 51360604

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The IUPAC name of 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine (CID 90159283) is 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The canonical SMILES for 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine is NCCc1c(-c2cccc(Cl)c2)nc2ccc(C(F)(F)F)cn12.
What is the InChIKey of 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The InChIKey is ZQZNRYSNZOWBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClF3N3/c17-12-3-1-2-10(8-12)15-13(6-7-21)23-9-11(16(18,19)20)4-5-14(23)22-15/h1-5,8-9H,6-7,21H2.
What are the key properties of 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine?
2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine has a molecular weight of 339.75 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chlorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]ethanamine is sourced from PubChem (CID 90159283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).