N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide

C26H22N8O2 — CID 67261289

IUPACN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(-c5nnco5)ccn34)c12
InChIInChI=1S/C26H22N8O2/c1-3-19-24-20(8-5-9-21(24)34(32-19)14-18-7-4-6-16(2)29-18)30-25(35)22-13-27-23-12-17(10-11-33(22)23)26-31-28-15-36-26/h4-13,15H,3,14H2,1-2H3,(H,30,35)
InChIKeyANEIMXYWFGGHQX-UHFFFAOYSA-N
MW478.52 g/mol
LogP4.30
Rot. Bonds6

About N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide

N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 67261289) has the molecular formula C26H22N8O2 and a molecular weight of 478.52 g/mol. Its IUPAC name is N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID67261289
Molecular FormulaC26H22N8O2
Molecular Weight478.52 g/mol
Exact Mass478.19
IUPAC NameN-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(-c5nnco5)ccn34)c12
InChIInChI=1S/C26H22N8O2/c1-3-19-24-20(8-5-9-21(24)34(32-19)14-18-7-4-6-16(2)29-18)30-25(35)22-13-27-23-12-17(10-11-33(22)23)26-31-28-15-36-26/h4-13,15H,3,14H2,1-2H3,(H,30,35)
InChIKeyANEIMXYWFGGHQX-UHFFFAOYSA-N
XLogP4.30
TPSA116.03 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.52
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 67261289) is N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide is CCc1nn(Cc2cccc(C)n2)c2cccc(NC(=O)c3cnc4cc(-c5nnco5)ccn34)c12.
What is the InChIKey of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ANEIMXYWFGGHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N8O2/c1-3-19-24-20(8-5-9-21(24)34(32-19)14-18-7-4-6-16(2)29-18)30-25(35)22-13-27-23-12-17(10-11-33(22)23)26-31-28-15-36-26/h4-13,15H,3,14H2,1-2H3,(H,30,35).
What are the key properties of N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 478.52 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-ethyl-1-[(6-methyl-2-pyridinyl)methyl]indazol-4-yl]-7-(1,3,4-oxadiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 67261289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).