6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine

C17H16F3N3O — CID 141352601

IUPAC6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine
SMILESCOc1ccccc1-c1cc(NCCC(F)(F)F)c2nccn2c1
InChIInChI=1S/C17H16F3N3O/c1-24-15-5-3-2-4-13(15)12-10-14(21-7-6-17(18,19)20)16-22-8-9-23(16)11-12/h2-5,8-11,21H,6-7H2,1H3
InChIKeyKTYQYHLCKJSMIX-UHFFFAOYSA-N
MW335.33 g/mol
LogP4.37
Rot. Bonds5

About 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine

6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine (PubChem CID 141352601) has the molecular formula C17H16F3N3O and a molecular weight of 335.33 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound Name6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine
PubChem CID141352601
Molecular FormulaC17H16F3N3O
Molecular Weight335.33 g/mol
Exact Mass335.12
IUPAC Name6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine
SMILESCOc1ccccc1-c1cc(NCCC(F)(F)F)c2nccn2c1
InChIInChI=1S/C17H16F3N3O/c1-24-15-5-3-2-4-13(15)12-10-14(21-7-6-17(18,19)20)16-22-8-9-23(16)11-12/h2-5,8-11,21H,6-7H2,1H3
InChIKeyKTYQYHLCKJSMIX-UHFFFAOYSA-N
XLogP4.37
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.33
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine?
The IUPAC name of 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine (CID 141352601) is 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine is COc1ccccc1-c1cc(NCCC(F)(F)F)c2nccn2c1.
What is the InChIKey of 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine?
The InChIKey is KTYQYHLCKJSMIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F3N3O/c1-24-15-5-3-2-4-13(15)12-10-14(21-7-6-17(18,19)20)16-22-8-9-23(16)11-12/h2-5,8-11,21H,6-7H2,1H3.
What are the key properties of 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine?
6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine has a molecular weight of 335.33 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 141352601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).