5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide

C29H33N7O2 — CID 154639948

IUPAC5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide
SMILESCC(C)c1c(-c2ccc3nccn3c2)[nH]c2ccc(-c3nnc(C(=O)NC4CCN(C(C)C)CC4)o3)cc12
InChIInChI=1S/C29H33N7O2/c1-17(2)25-22-15-19(5-7-23(22)32-26(25)20-6-8-24-30-11-14-36(24)16-20)28-33-34-29(38-28)27(37)31-21-9-12-35(13-10-21)18(3)4/h5-8,11,14-18,21,32H,9-10,12-13H2,1-4H3,(H,31,37)
InChIKeyUOBAUBZEYNDAFP-UHFFFAOYSA-N
MW511.63 g/mol
LogP5.26
Rot. Bonds6

About 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide

5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide (PubChem CID 154639948) has the molecular formula C29H33N7O2 and a molecular weight of 511.63 g/mol. Its IUPAC name is 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound Name5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide
PubChem CID154639948
Molecular FormulaC29H33N7O2
Molecular Weight511.63 g/mol
Exact Mass511.27
IUPAC Name5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide
SMILESCC(C)c1c(-c2ccc3nccn3c2)[nH]c2ccc(-c3nnc(C(=O)NC4CCN(C(C)C)CC4)o3)cc12
InChIInChI=1S/C29H33N7O2/c1-17(2)25-22-15-19(5-7-23(22)32-26(25)20-6-8-24-30-11-14-36(24)16-20)28-33-34-29(38-28)27(37)31-21-9-12-35(13-10-21)18(3)4/h5-8,11,14-18,21,32H,9-10,12-13H2,1-4H3,(H,31,37)
InChIKeyUOBAUBZEYNDAFP-UHFFFAOYSA-N
XLogP5.26
TPSA104.35 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.63
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide (CID 154639948) is 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide is CC(C)c1c(-c2ccc3nccn3c2)[nH]c2ccc(-c3nnc(C(=O)NC4CCN(C(C)C)CC4)o3)cc12.
What is the InChIKey of 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is UOBAUBZEYNDAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N7O2/c1-17(2)25-22-15-19(5-7-23(22)32-26(25)20-6-8-24-30-11-14-36(24)16-20)28-33-34-29(38-28)27(37)31-21-9-12-35(13-10-21)18(3)4/h5-8,11,14-18,21,32H,9-10,12-13H2,1-4H3,(H,31,37).
What are the key properties of 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide?
5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 511.63 g/mol, XLogP of 5.26, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-imidazo[1,2-a]pyridin-6-yl-3-propan-2-yl-1H-indol-5-yl)-N-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 154639948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).