N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide

C24H24N6O4 — CID 71281258

IUPACN-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(CNC(=O)C3CCOCC3)n2)cc1NC(=O)c1cnc2ccccn12
InChIInChI=1S/C24H24N6O4/c1-15-5-6-17(12-18(15)27-24(32)19-13-25-20-4-2-3-9-30(19)20)22-28-21(34-29-22)14-26-23(31)16-7-10-33-11-8-16/h2-6,9,12-13,16H,7-8,10-11,14H2,1H3,(H,26,31)(H,27,32)
InChIKeyGKWIRIRAAALIKI-UHFFFAOYSA-N
MW460.49 g/mol
LogP2.99
Rot. Bonds6

About N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide

N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71281258) has the molecular formula C24H24N6O4 and a molecular weight of 460.49 g/mol. Its IUPAC name is N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID71281258
Molecular FormulaC24H24N6O4
Molecular Weight460.49 g/mol
Exact Mass460.19
IUPAC NameN-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(CNC(=O)C3CCOCC3)n2)cc1NC(=O)c1cnc2ccccn12
InChIInChI=1S/C24H24N6O4/c1-15-5-6-17(12-18(15)27-24(32)19-13-25-20-4-2-3-9-30(19)20)22-28-21(34-29-22)14-26-23(31)16-7-10-33-11-8-16/h2-6,9,12-13,16H,7-8,10-11,14H2,1H3,(H,26,31)(H,27,32)
InChIKeyGKWIRIRAAALIKI-UHFFFAOYSA-N
XLogP2.99
TPSA123.65 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

N-[2-methyl-5-[5-[(methylcarbamoylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71291711
N-[2-methyl-5-[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71281207
N-[5-[5-(fluoromethyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71282200
N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71280864
N-[5-[5-(2-hydroxy-2-methylpropyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71291760
ethane;N-[5-[5-[2-(1-hydroxycyclopropyl)ethyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 144545115
N-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide;methanesulfonamide
CID 171796253
N-[5-[5-[2-(1-hydroxycyclopropyl)ethyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71280638
N-[2-methyl-5-[5-[[3-(2,2,2-trifluoroethoxy)propanoylamino]methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71282438
N-[2-methyl-5-[5-[(3-methylsulfonylazetidin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71289586
N-[5-[5-[(2R)-azetidin-2-yl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 171796698
N-[5-[5-[3-(diethylamino)-3-oxopropyl]-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71282350

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 71281258) is N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(-c2noc(CNC(=O)C3CCOCC3)n2)cc1NC(=O)c1cnc2ccccn12.
What is the InChIKey of N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is GKWIRIRAAALIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O4/c1-15-5-6-17(12-18(15)27-24(32)19-13-25-20-4-2-3-9-30(19)20)22-28-21(34-29-22)14-26-23(31)16-7-10-33-11-8-16/h2-6,9,12-13,16H,7-8,10-11,14H2,1H3,(H,26,31)(H,27,32).
What are the key properties of N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 460.49 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-[5-[(oxane-4-carbonylamino)methyl]-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71281258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).