3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

C16H19FN2 — CID 146634254

IUPAC3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)c1ccc(-c2ncc3n2CCCC3)cc1F
InChIInChI=1S/C16H19FN2/c1-11(2)14-7-6-12(9-15(14)17)16-18-10-13-5-3-4-8-19(13)16/h6-7,9-11H,3-5,8H2,1-2H3
InChIKeyCAWWIVIJTDGNKV-UHFFFAOYSA-N
MW258.34 g/mol
LogP4.15
Rot. Bonds2

About 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine

3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (PubChem CID 146634254) has the molecular formula C16H19FN2 and a molecular weight of 258.34 g/mol. Its IUPAC name is 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
PubChem CID146634254
Molecular FormulaC16H19FN2
Molecular Weight258.34 g/mol
Exact Mass258.15
IUPAC Name3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
SMILESCC(C)c1ccc(-c2ncc3n2CCCC3)cc1F
InChIInChI=1S/C16H19FN2/c1-11(2)14-7-6-12(9-15(14)17)16-18-10-13-5-3-4-8-19(13)16/h6-7,9-11H,3-5,8H2,1-2H3
InChIKeyCAWWIVIJTDGNKV-UHFFFAOYSA-N
XLogP4.15
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The IUPAC name of 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine (CID 146634254) is 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The canonical SMILES for 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is CC(C)c1ccc(-c2ncc3n2CCCC3)cc1F.
What is the InChIKey of 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
The InChIKey is CAWWIVIJTDGNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2/c1-11(2)14-7-6-12(9-15(14)17)16-18-10-13-5-3-4-8-19(13)16/h6-7,9-11H,3-5,8H2,1-2H3.
What are the key properties of 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine?
3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine has a molecular weight of 258.34 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-4-propan-2-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine is sourced from PubChem (CID 146634254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).