4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C15H18FN3 — CID 83672719

IUPAC4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)n1cnc2c1C(c1cccc(F)c1)NCC2
InChIInChI=1S/C15H18FN3/c1-10(2)19-9-18-13-6-7-17-14(15(13)19)11-4-3-5-12(16)8-11/h3-5,8-10,14,17H,6-7H2,1-2H3
InChIKeyBXCLKFWJADFBTR-UHFFFAOYSA-N
MW259.33 g/mol
LogP2.84
Rot. Bonds2

About 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 83672719) has the molecular formula C15H18FN3 and a molecular weight of 259.33 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID83672719
Molecular FormulaC15H18FN3
Molecular Weight259.33 g/mol
Exact Mass259.15
IUPAC Name4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)n1cnc2c1C(c1cccc(F)c1)NCC2
InChIInChI=1S/C15H18FN3/c1-10(2)19-9-18-13-6-7-17-14(15(13)19)11-4-3-5-12(16)8-11/h3-5,8-10,14,17H,6-7H2,1-2H3
InChIKeyBXCLKFWJADFBTR-UHFFFAOYSA-N
XLogP2.84
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluorophenyl)-1-[(1-propan-2-ylimidazol-2-yl)methyl]piperazine
CID 120756439
6-(3-fluorophenyl)-N-(2-methoxyethyl)-1,2,3,6-tetrahydropyrazin-5-amine
CID 50767870
7-(3-fluorophenyl)-2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
CID 136933815
N-cyclohexyl-6-(3-fluorophenyl)-1,2,3,6-tetrahydropyrazin-5-amine
CID 50767865
3-propan-2-yl-5,6-dihydro-4H-cyclopenta[d]imidazol-4-amine
CID 83873386
2-(3-fluorophenyl)-3-methylpyrrolidine
CID 3582862
methyl (6R)-6-(3-fluorophenyl)-4-methyl-2-oxo-3-propan-2-yl-1,6-dihydropyrimidine-5-carboxylate
CID 9449148
2-(3-fluorophenyl)-1-(1-propan-2-ylimidazol-4-yl)sulfonylpiperazine;hydrochloride
CID 120764443
(2S,4R)-2-(3-fluorophenyl)-N-propan-2-ylpiperidin-4-amine
CID 167460306
[2-(3-fluorophenyl)piperazin-1-yl]-(1-propan-2-ylpiperidin-4-yl)methanone
CID 120736138
5-[[2-(3-fluorophenyl)piperazin-1-yl]methyl]-2-propan-2-yl-1,3-thiazole
CID 120768704
[(2S,3R)-3-(3-fluorophenyl)pyrrolidin-2-yl]methanol
CID 131114074

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 83672719) is 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CC(C)n1cnc2c1C(c1cccc(F)c1)NCC2.
What is the InChIKey of 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is BXCLKFWJADFBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3/c1-10(2)19-9-18-13-6-7-17-14(15(13)19)11-4-3-5-12(16)8-11/h3-5,8-10,14,17H,6-7H2,1-2H3.
What are the key properties of 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 259.33 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-3-propan-2-yl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 83672719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).