[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol

C24H20FN5O — CID 58449879

IUPAC[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol
SMILESCc1cn(-c2ccc(Nc3cccn4cc(-c5ccc(F)cc5)nc34)cc2CO)cn1
InChIInChI=1S/C24H20FN5O/c1-16-12-30(15-26-16)23-9-8-20(11-18(23)14-31)27-21-3-2-10-29-13-22(28-24(21)29)17-4-6-19(25)7-5-17/h2-13,15,27,31H,14H2,1H3
InChIKeyFTNCHNHFLTUHTF-UHFFFAOYSA-N
MW413.46 g/mol
LogP4.87
Rot. Bonds5

About [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol

[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol (PubChem CID 58449879) has the molecular formula C24H20FN5O and a molecular weight of 413.46 g/mol. Its IUPAC name is [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol.

Molecular Properties

Compound Name[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol
PubChem CID58449879
Molecular FormulaC24H20FN5O
Molecular Weight413.46 g/mol
Exact Mass413.17
IUPAC Name[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol
SMILESCc1cn(-c2ccc(Nc3cccn4cc(-c5ccc(F)cc5)nc34)cc2CO)cn1
InChIInChI=1S/C24H20FN5O/c1-16-12-30(15-26-16)23-9-8-20(11-18(23)14-31)27-21-3-2-10-29-13-22(28-24(21)29)17-4-6-19(25)7-5-17/h2-13,15,27,31H,14H2,1H3
InChIKeyFTNCHNHFLTUHTF-UHFFFAOYSA-N
XLogP4.87
TPSA67.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.46
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol?
The IUPAC name of [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol (CID 58449879) is [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol.
What is the SMILES notation for [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol?
The canonical SMILES for [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol is Cc1cn(-c2ccc(Nc3cccn4cc(-c5ccc(F)cc5)nc34)cc2CO)cn1.
What is the InChIKey of [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol?
The InChIKey is FTNCHNHFLTUHTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN5O/c1-16-12-30(15-26-16)23-9-8-20(11-18(23)14-31)27-21-3-2-10-29-13-22(28-24(21)29)17-4-6-19(25)7-5-17/h2-13,15,27,31H,14H2,1H3.
What are the key properties of [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol?
[5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol has a molecular weight of 413.46 g/mol, XLogP of 4.87, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-8-yl]amino]-2-(4-methylimidazol-1-yl)phenyl]methanol is sourced from PubChem (CID 58449879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).