[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol

C22H20FN5O2 — CID 58824388

IUPAC[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
SMILESOCc1ccn2c(-c3ccnc(N4CCOCC4)n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C22H20FN5O2/c23-17-3-1-16(2-4-17)20-21(28-8-6-15(14-29)13-19(28)26-20)18-5-7-24-22(25-18)27-9-11-30-12-10-27/h1-8,13,29H,9-12,14H2
InChIKeyXNILSWLXMZZGJP-UHFFFAOYSA-N
MW405.43 g/mol
LogP2.93
Rot. Bonds4

About [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol

[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol (PubChem CID 58824388) has the molecular formula C22H20FN5O2 and a molecular weight of 405.43 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
PubChem CID58824388
Molecular FormulaC22H20FN5O2
Molecular Weight405.43 g/mol
Exact Mass405.16
IUPAC Name[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
SMILESOCc1ccn2c(-c3ccnc(N4CCOCC4)n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C22H20FN5O2/c23-17-3-1-16(2-4-17)20-21(28-8-6-15(14-29)13-19(28)26-20)18-5-7-24-22(25-18)27-9-11-30-12-10-27/h1-8,13,29H,9-12,14H2
InChIKeyXNILSWLXMZZGJP-UHFFFAOYSA-N
XLogP2.93
TPSA75.78 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?
The IUPAC name of [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol (CID 58824388) is [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol.
What is the SMILES notation for [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?
The canonical SMILES for [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol is OCc1ccn2c(-c3ccnc(N4CCOCC4)n3)c(-c3ccc(F)cc3)nc2c1.
What is the InChIKey of [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?
The InChIKey is XNILSWLXMZZGJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN5O2/c23-17-3-1-16(2-4-17)20-21(28-8-6-15(14-29)13-19(28)26-20)18-5-7-24-22(25-18)27-9-11-30-12-10-27/h1-8,13,29H,9-12,14H2.
What are the key properties of [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?
[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol has a molecular weight of 405.43 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol is sourced from PubChem (CID 58824388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).