N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

C25H24N6O2 — CID 67260539

IUPACN-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccc(Cn2nc(CC)c3c(NC(=O)c4cnc5ccccn45)cccc32)n1
InChIInChI=1S/C25H24N6O2/c1-3-18-24-19(28-25(32)21-15-26-22-12-5-6-14-30(21)22)10-8-11-20(24)31(29-18)16-17-9-7-13-23(27-17)33-4-2/h5-15H,3-4,16H2,1-2H3,(H,28,32)
InChIKeyOLGIGQBWLWENEI-UHFFFAOYSA-N
MW440.51 g/mol
LogP4.34
Rot. Bonds7

About N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 67260539) has the molecular formula C25H24N6O2 and a molecular weight of 440.51 g/mol. Its IUPAC name is N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID67260539
Molecular FormulaC25H24N6O2
Molecular Weight440.51 g/mol
Exact Mass440.20
IUPAC NameN-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccc(Cn2nc(CC)c3c(NC(=O)c4cnc5ccccn45)cccc32)n1
InChIInChI=1S/C25H24N6O2/c1-3-18-24-19(28-25(32)21-15-26-22-12-5-6-14-30(21)22)10-8-11-20(24)31(29-18)16-17-9-7-13-23(27-17)33-4-2/h5-15H,3-4,16H2,1-2H3,(H,28,32)
InChIKeyOLGIGQBWLWENEI-UHFFFAOYSA-N
XLogP4.34
TPSA86.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.51
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 67260539) is N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is CCOc1cccc(Cn2nc(CC)c3c(NC(=O)c4cnc5ccccn45)cccc32)n1.
What is the InChIKey of N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is OLGIGQBWLWENEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O2/c1-3-18-24-19(28-25(32)21-15-26-22-12-5-6-14-30(21)22)10-8-11-20(24)31(29-18)16-17-9-7-13-23(27-17)33-4-2/h5-15H,3-4,16H2,1-2H3,(H,28,32).
What are the key properties of N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 440.51 g/mol, XLogP of 4.34, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(6-ethoxy-2-pyridinyl)methyl]-3-ethylindazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 67260539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).