4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine

C26H25FN6O2S — CID 118258053

IUPAC4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine
SMILESCc1nn2ccc(OCCN3CCOCC3)cc2c1-c1nc(-c2ccccc2F)c(C2=NCC=N2)s1
InChIInChI=1S/C26H25FN6O2S/c1-17-22(21-16-18(6-9-33(21)31-17)35-15-12-32-10-13-34-14-11-32)26-30-23(19-4-2-3-5-20(19)27)24(36-26)25-28-7-8-29-25/h2-7,9,16H,8,10-15H2,1H3
InChIKeyTZQCNQDIFBSAAJ-UHFFFAOYSA-N
MW504.59 g/mol
LogP4.11
Rot. Bonds7

About 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine

4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine (PubChem CID 118258053) has the molecular formula C26H25FN6O2S and a molecular weight of 504.59 g/mol. Its IUPAC name is 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine
PubChem CID118258053
Molecular FormulaC26H25FN6O2S
Molecular Weight504.59 g/mol
Exact Mass504.17
IUPAC Name4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine
SMILESCc1nn2ccc(OCCN3CCOCC3)cc2c1-c1nc(-c2ccccc2F)c(C2=NCC=N2)s1
InChIInChI=1S/C26H25FN6O2S/c1-17-22(21-16-18(6-9-33(21)31-17)35-15-12-32-10-13-34-14-11-32)26-30-23(19-4-2-3-5-20(19)27)24(36-26)25-28-7-8-29-25/h2-7,9,16H,8,10-15H2,1H3
InChIKeyTZQCNQDIFBSAAJ-UHFFFAOYSA-N
XLogP4.11
TPSA76.61 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500504.59
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

2-[5-[2-(4-fluoropiperidin-1-yl)ethoxy]-2-methylpyrazolo[1,5-a]pyridin-3-yl]-5-[1-(oxan-2-yl)-1,2,4-triazol-3-yl]-4-phenyl-1,3-thiazole
CID 66855151
2-[5-[2-(4-fluoropiperidin-1-yl)ethoxy]-2-methylpyrazolo[1,5-a]pyridin-3-yl]-5-(1H-imidazol-2-yl)-4-phenyl-1,3-thiazole
CID 118258057
4-(2-fluoro-6-methoxyphenyl)-N'-methanimidoyl-2-[2-methyl-5-(2-piperazin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]-1,3-thiazole-5-carboximidamide
CID 91058040
2-[2-methyl-3-[4-phenyl-5-(4H-pyrazol-3-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyridin-5-yl]oxyethanol
CID 58095053
4-(2-fluorophenyl)-5-(4H-imidazol-5-yl)-2-(2-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole
CID 58095190
2-[5-[2-(4-fluoropiperidin-1-yl)ethoxy]-2-methylpyrazolo[1,5-a]pyridin-3-yl]-4-phenyl-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazole;bis(4-methylbenzenesulfonic acid);pyrazolo[1,5-a]pyridine
CID 160558787
N'-methanimidoyl-4-methyl-2-[2-methyl-5-(2-morpholin-4-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]-4-phenyl-5H-1,3-thiazole-5-carboximidamide
CID 147262490
4-[2-methyl-3-[4-phenyl-5-(1H-1,2,4-triazol-5-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyridin-5-yl]morpholine
CID 58095208
ethane;4-[2-(3-methylphenoxy)ethyl]morpholine
CID 143019407
4-[2-[4-(2,4-difluorophenyl)-3-methylphenoxy]ethyl]morpholine
CID 173296855
N-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1-[3-(2-morpholin-4-ylethoxy)phenyl]methanamine
CID 77097932
4-[2-(4-methylnaphthalen-2-yl)oxyethyl]morpholine
CID 143504994

Frequently Asked Questions

What is the IUPAC name of 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine (CID 118258053) is 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine is Cc1nn2ccc(OCCN3CCOCC3)cc2c1-c1nc(-c2ccccc2F)c(C2=NCC=N2)s1.
What is the InChIKey of 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine?
The InChIKey is TZQCNQDIFBSAAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25FN6O2S/c1-17-22(21-16-18(6-9-33(21)31-17)35-15-12-32-10-13-34-14-11-32)26-30-23(19-4-2-3-5-20(19)27)24(36-26)25-28-7-8-29-25/h2-7,9,16H,8,10-15H2,1H3.
What are the key properties of 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine?
4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine has a molecular weight of 504.59 g/mol, XLogP of 4.11, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[3-[4-(2-fluorophenyl)-5-(4H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-methylpyrazolo[1,5-a]pyridin-5-yl]oxyethyl]morpholine is sourced from PubChem (CID 118258053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).