2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine

C15H18FN3O — CID 83966130

IUPAC2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
SMILESCCOc1ccc(-c2cn3c(n2)C(N)CC(F)C3)cc1
InChIInChI=1S/C15H18FN3O/c1-2-20-12-5-3-10(4-6-12)14-9-19-8-11(16)7-13(17)15(19)18-14/h3-6,9,11,13H,2,7-8,17H2,1H3
InChIKeyBJDMBIMKJMIPJN-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.69
Rot. Bonds3

About 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine

2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine (PubChem CID 83966130) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
PubChem CID83966130
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
SMILESCCOc1ccc(-c2cn3c(n2)C(N)CC(F)C3)cc1
InChIInChI=1S/C15H18FN3O/c1-2-20-12-5-3-10(4-6-12)14-9-19-8-11(16)7-13(17)15(19)18-14/h3-6,9,11,13H,2,7-8,17H2,1H3
InChIKeyBJDMBIMKJMIPJN-UHFFFAOYSA-N
XLogP2.69
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine?
The IUPAC name of 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine (CID 83966130) is 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine.
What is the SMILES notation for 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine?
The canonical SMILES for 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine is CCOc1ccc(-c2cn3c(n2)C(N)CC(F)C3)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine?
The InChIKey is BJDMBIMKJMIPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-2-20-12-5-3-10(4-6-12)14-9-19-8-11(16)7-13(17)15(19)18-14/h3-6,9,11,13H,2,7-8,17H2,1H3.
What are the key properties of 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine?
2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine has a molecular weight of 275.33 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-6-fluoro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 83966130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).