3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide

C25H25N7O — CID 67983959

IUPAC3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide
SMILESO=C(NC1CCCC(Cn2cccn2)C1)c1ccc2[nH]nc(-c3ccc4nccn4c3)c2c1
InChIInChI=1S/C25H25N7O/c33-25(28-20-4-1-3-17(13-20)15-32-11-2-9-27-32)18-5-7-22-21(14-18)24(30-29-22)19-6-8-23-26-10-12-31(23)16-19/h2,5-12,14,16-17,20H,1,3-4,13,15H2,(H,28,33)(H,29,30)
InChIKeyBLBWBWJABRFCML-UHFFFAOYSA-N
MW439.52 g/mol
LogP4.06
Rot. Bonds5

About 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide

3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide (PubChem CID 67983959) has the molecular formula C25H25N7O and a molecular weight of 439.52 g/mol. Its IUPAC name is 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide
PubChem CID67983959
Molecular FormulaC25H25N7O
Molecular Weight439.52 g/mol
Exact Mass439.21
IUPAC Name3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide
SMILESO=C(NC1CCCC(Cn2cccn2)C1)c1ccc2[nH]nc(-c3ccc4nccn4c3)c2c1
InChIInChI=1S/C25H25N7O/c33-25(28-20-4-1-3-17(13-20)15-32-11-2-9-27-32)18-5-7-22-21(14-18)24(30-29-22)19-6-8-23-26-10-12-31(23)16-19/h2,5-12,14,16-17,20H,1,3-4,13,15H2,(H,28,33)(H,29,30)
InChIKeyBLBWBWJABRFCML-UHFFFAOYSA-N
XLogP4.06
TPSA92.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.52
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide?
The IUPAC name of 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide (CID 67983959) is 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide?
The canonical SMILES for 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide is O=C(NC1CCCC(Cn2cccn2)C1)c1ccc2[nH]nc(-c3ccc4nccn4c3)c2c1.
What is the InChIKey of 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide?
The InChIKey is BLBWBWJABRFCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N7O/c33-25(28-20-4-1-3-17(13-20)15-32-11-2-9-27-32)18-5-7-22-21(14-18)24(30-29-22)19-6-8-23-26-10-12-31(23)16-19/h2,5-12,14,16-17,20H,1,3-4,13,15H2,(H,28,33)(H,29,30).
What are the key properties of 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide?
3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide has a molecular weight of 439.52 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-a]pyridin-6-yl-N-[3-(pyrazol-1-ylmethyl)cyclohexyl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 67983959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).