5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine

C22H21F2N5OS — CID 58207995

IUPAC5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESFc1ccc(-c2cc(-c3cnc(NCCN4CCOCC4)s3)cn3ccnc23)c(F)c1
InChIInChI=1S/C22H21F2N5OS/c23-16-1-2-17(19(24)12-16)18-11-15(14-29-6-4-25-21(18)29)20-13-27-22(31-20)26-3-5-28-7-9-30-10-8-28/h1-2,4,6,11-14H,3,5,7-10H2,(H,26,27)
InChIKeyXQQAMCBIRGOCGH-UHFFFAOYSA-N
MW441.51 g/mol
LogP4.15
Rot. Bonds6

About 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine

5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine (PubChem CID 58207995) has the molecular formula C22H21F2N5OS and a molecular weight of 441.51 g/mol. Its IUPAC name is 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
PubChem CID58207995
Molecular FormulaC22H21F2N5OS
Molecular Weight441.51 g/mol
Exact Mass441.14
IUPAC Name5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
SMILESFc1ccc(-c2cc(-c3cnc(NCCN4CCOCC4)s3)cn3ccnc23)c(F)c1
InChIInChI=1S/C22H21F2N5OS/c23-16-1-2-17(19(24)12-16)18-11-15(14-29-6-4-25-21(18)29)20-13-27-22(31-20)26-3-5-28-7-9-30-10-8-28/h1-2,4,6,11-14H,3,5,7-10H2,(H,26,27)
InChIKeyXQQAMCBIRGOCGH-UHFFFAOYSA-N
XLogP4.15
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.51
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine (CID 58207995) is 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine is Fc1ccc(-c2cc(-c3cnc(NCCN4CCOCC4)s3)cn3ccnc23)c(F)c1.
What is the InChIKey of 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is XQQAMCBIRGOCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21F2N5OS/c23-16-1-2-17(19(24)12-16)18-11-15(14-29-6-4-25-21(18)29)20-13-27-22(31-20)26-3-5-28-7-9-30-10-8-28/h1-2,4,6,11-14H,3,5,7-10H2,(H,26,27).
What are the key properties of 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine?
5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 441.51 g/mol, XLogP of 4.15, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[8-(2,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 58207995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).