(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol

C24H23ClFN5O2 — CID 144859232

IUPAC(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCCc1nc2cc(F)c(-c3cnc(N4CCOCC4)nc3)cn2c1C(O)c1cccc(Cl)c1
InChIInChI=1S/C24H23ClFN5O2/c1-2-20-22(23(32)15-4-3-5-17(25)10-15)31-14-18(19(26)11-21(31)29-20)16-12-27-24(28-13-16)30-6-8-33-9-7-30/h3-5,10-14,23,32H,2,6-9H2,1H3
InChIKeyXBQORHVBERKHOP-UHFFFAOYSA-N
MW467.93 g/mol
LogP4.06
Rot. Bonds5

About (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol

(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 144859232) has the molecular formula C24H23ClFN5O2 and a molecular weight of 467.93 g/mol. Its IUPAC name is (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Name(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID144859232
Molecular FormulaC24H23ClFN5O2
Molecular Weight467.93 g/mol
Exact Mass467.15
IUPAC Name(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCCc1nc2cc(F)c(-c3cnc(N4CCOCC4)nc3)cn2c1C(O)c1cccc(Cl)c1
InChIInChI=1S/C24H23ClFN5O2/c1-2-20-22(23(32)15-4-3-5-17(25)10-15)31-14-18(19(26)11-21(31)29-20)16-12-27-24(28-13-16)30-6-8-33-9-7-30/h3-5,10-14,23,32H,2,6-9H2,1H3
InChIKeyXBQORHVBERKHOP-UHFFFAOYSA-N
XLogP4.06
TPSA75.78 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.93
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(3-Chloro-phenyl)-6-[(4-cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-methoxymethyl]-2-(4-methyl-piperazin-1-yl)-nicotinonitrile
CID 44286345
5-(3-Chlorophenyl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-2-(4-hydroxypiperidin-1-yl)pyridine-3-carbonitrile
CID 44286755
5-(3-Chloro-phenyl)-6-[(4-cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-methoxymethyl]-2-morpholin-4-yl-nicotinonitrile
CID 44286780
{3-[2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-2-fluorophenyl}methanol
CID 44231745
{3-[2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-2,6-difluorophenyl}-methanol
CID 44231857
Racemic 1-{3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl}ethanol
CID 67046247
4-[2-Methyl-3-[6-(2-propan-2-yloxyethyl)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 67424114
2-[5-(2-Methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]ethanol
CID 67438484
US11420970, Example 26
CID 156073369
1-[3-Chloro-4-(2-ethyl-3-pentan-2-ylimidazo[4,5-b]pyridin-7-yl)phenyl]ethanol
CID 44458818
2-[5-Chloro-2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridin-7-yl]ethanol
CID 45487937
2-[2-Amino-5-(4-methylpiperazin-1-yl)imidazo[4,5-b]pyridin-3-yl]-1-[2-chloro-4-(trifluoromethyl)phenyl]ethanol
CID 90644773

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol (CID 144859232) is (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol is CCc1nc2cc(F)c(-c3cnc(N4CCOCC4)nc3)cn2c1C(O)c1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is XBQORHVBERKHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClFN5O2/c1-2-20-22(23(32)15-4-3-5-17(25)10-15)31-14-18(19(26)11-21(31)29-20)16-12-27-24(28-13-16)30-6-8-33-9-7-30/h3-5,10-14,23,32H,2,6-9H2,1H3.
What are the key properties of (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol?
(3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 467.93 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-[2-ethyl-7-fluoro-6-(2-morpholin-4-ylpyrimidin-5-yl)imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 144859232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).